#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ffs n LYS 4 N 0.00 0.00 -2.50 -0.78 4.76 -1.26 -4.81 118.16 113.57 3ffs n LYS 4 Ca 0.00 0.00 -0.39 0.00 -2.87 0.00 0.00 58.31 55.05 3ffs n LYS 4 Cb 0.00 0.00 -0.04 0.00 -1.84 0.00 0.00 35.03 33.15 3ffs n LYS 4 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 3ffs s ASN 5 N -1.59 7.15 -0.32 4.39 4.22 -1.26 -4.94 114.94 122.59 3ffs s ASN 5 Ca 0.00 2.20 0.07 0.00 -2.14 0.00 0.00 52.86 52.99 3ffs s ASN 5 Cb 0.00 -2.62 0.46 0.00 1.28 0.00 0.00 41.25 40.37 3ffs s ASN 5 CO 0.00 -0.22 1.22 2.30 -2.04 0.00 0.00 177.10 178.35 3ffs n ILE 6 N 0.88 2.56 0.00 0.54 -5.35 -1.26 -5.07 119.36 111.66 3ffs n ILE 6 Ca 0.00 -4.23 0.00 0.00 -0.27 0.00 0.00 62.75 58.26 3ffs n ILE 6 Cb 0.46 -1.15 0.00 0.00 -1.74 0.00 0.00 39.64 37.21 3ffs n ILE 6 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3ffs n GLY 7 N -0.70 0.36 3.66 3.28 0.00 -1.26 -4.88 105.19 105.64 3ffs n GLY 7 Ca 0.44 -1.76 -0.43 0.00 0.00 0.00 0.00 46.02 44.28 3ffs n GLY 7 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3ffs s LYS 8 N -2.69 4.14 0.13 1.61 0.00 -1.26 -5.02 119.74 116.66 3ffs s LYS 8 Ca 0.00 1.97 -0.18 0.00 0.00 0.00 0.00 55.97 57.76 3ffs s LYS 8 Cb 0.00 -3.93 -0.07 0.00 0.00 0.00 0.00 37.83 33.82 3ffs s LYS 8 CO 0.00 -0.87 0.61 0.20 0.00 0.00 0.00 175.35 175.29 3ffs s GLY 9 N 3.11 2.62 0.06 0.59 0.00 -1.26 -5.05 107.32 107.38 3ffs s GLY 9 Ca 0.68 0.04 0.07 0.00 0.00 0.00 0.00 44.72 45.52 3ffs s GLY 9 CO 0.25 0.42 -0.16 1.08 0.00 0.00 0.00 173.10 174.69 3ffs s LEU 10 N -1.54 2.71 0.41 0.66 1.02 -1.26 -4.85 118.68 115.83 3ffs s LEU 10 Ca 0.35 -0.43 0.07 0.00 0.02 0.00 0.00 54.13 54.15 3ffs s LEU 10 Cb -0.18 -1.58 -0.07 0.00 0.02 0.00 0.00 46.19 44.39 3ffs s LEU 10 CO 0.20 0.24 0.10 0.42 0.02 0.00 0.00 176.35 177.32 3ffs s THR 11 N -1.00 2.15 0.35 5.49 -4.23 -1.26 -1.90 115.64 115.24 3ffs s THR 11 Ca 0.16 -1.85 0.16 0.00 -1.18 0.00 0.00 61.69 58.99 3ffs s THR 11 Cb -0.11 -2.99 0.34 0.00 1.34 0.00 0.00 72.50 71.08 3ffs s THR 11 CO 0.07 0.00 1.63 -0.26 -0.54 0.00 0.00 174.62 175.52 3ffs h PHE 12 N 1.59 0.86 0.00 3.99 -1.00 -1.93 0.16 116.94 120.60 3ffs h PHE 12 Ca -0.43 0.04 0.00 0.00 2.81 0.00 0.00 57.97 60.39 3ffs h PHE 12 Cb 1.25 -0.21 0.00 0.00 3.61 0.00 0.00 35.95 40.60 3ffs h PHE 12 CO 0.69 -0.30 0.00 1.49 -1.61 0.00 0.00 178.31 178.58 3ffs h GLU 13 N 0.19 0.00 0.00 1.51 4.57 -1.98 -3.06 114.58 115.81 3ffs h GLU 13 Ca 0.77 0.00 -0.07 0.00 -1.18 0.00 0.00 59.36 58.89 3ffs h GLU 13 Cb 1.87 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 30.45 3ffs h GLU 13 CO -0.68 0.00 -0.31 -0.44 -1.18 0.00 0.00 179.01 176.40 3ffs h ASP 14 N 0.00 0.00 -4.13 1.04 3.32 -0.99 -3.45 116.42 112.21 3ffs h ASP 14 Ca 0.00 0.00 -0.67 0.00 0.02 0.00 0.00 57.03 56.38 3ffs h ASP 14 Cb 0.69 0.00 -0.24 0.00 0.22 0.00 0.00 39.33 40.00 3ffs h ASP 14 CO 0.00 0.31 -0.87 0.27 -1.72 0.00 0.00 179.24 177.23 3ffs s ILE 15 N -3.09 2.11 0.12 0.35 -0.00 -1.16 -0.11 121.20 119.43 3ffs s ILE 15 Ca 0.05 -1.54 0.09 0.00 -0.00 0.00 0.00 60.65 59.25 3ffs s ILE 15 Cb 0.07 -1.84 -0.04 0.00 -0.00 0.00 0.00 42.46 40.65 3ffs s ILE 15 CO 0.71 0.20 -0.16 -0.76 -0.00 0.00 0.00 174.94 174.94 3ffs s LEU 16 N -1.62 2.79 0.38 0.37 1.43 -0.40 -4.94 118.68 116.69 3ffs s LEU 16 Ca 0.12 -0.54 -0.20 0.00 -1.03 0.00 0.00 54.13 52.49 3ffs s LEU 16 Cb -0.10 -1.60 -0.10 0.00 0.03 0.00 0.00 46.19 44.42 3ffs s LEU 16 CO 0.04 0.17 0.88 -0.76 0.23 0.00 0.00 176.35 176.90 3ffs s LEU 17 N -2.24 4.02 -0.35 1.79 1.43 -1.26 -1.53 118.68 120.54 3ffs s LEU 17 Ca 0.19 1.57 -0.10 0.00 -1.03 0.00 0.00 54.13 54.76 3ffs s LEU 17 Cb -0.10 -4.32 0.02 0.00 0.03 0.00 0.00 46.19 41.81 3ffs s LEU 17 CO 0.11 -0.28 0.17 -0.69 0.23 0.00 0.00 176.35 175.90 3ffs s VAL 18 N -2.05 4.41 -0.14 -1.59 1.01 0.09 -4.85 120.40 117.27 3ffs s VAL 18 Ca 0.58 -0.81 -0.38 0.00 0.00 0.00 0.00 61.98 61.36 3ffs s VAL 18 Cb -0.10 -3.42 -0.16 0.00 0.00 0.00 0.00 36.38 32.70 3ffs s VAL 18 CO 0.15 -0.15 1.63 -2.65 0.00 0.00 0.00 175.10 174.08 3ffs n PRO 19 N 4.96 1.26 -2.75 2.72 -0.02 -1.26 -4.53 135.00 135.37 3ffs n PRO 19 Ca -0.12 0.46 -0.17 0.00 -2.02 0.00 0.00 63.50 61.65 3ffs n PRO 19 Cb 0.46 -2.14 0.04 0.00 -0.02 0.00 0.00 33.50 31.85 3ffs n PRO 19 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 3ffs n ASN 20 N 4.53 1.85 -4.67 2.55 3.02 -0.94 -4.99 115.26 116.61 3ffs n ASN 20 Ca 0.23 -2.30 -0.42 0.00 -0.03 0.00 0.00 54.58 52.06 3ffs n ASN 20 Cb 0.16 -0.29 -0.03 0.00 -0.61 0.00 0.00 39.78 39.02 3ffs n ASN 20 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 3ffs s TYR 21 N -1.97 2.09 -0.45 3.10 5.04 -1.26 -4.69 117.35 119.21 3ffs s TYR 21 Ca 0.45 0.24 -0.01 0.00 -2.44 0.00 0.00 57.07 55.30 3ffs s TYR 21 Cb -0.04 -3.91 0.12 0.00 0.35 0.00 0.00 41.96 38.48 3ffs s TYR 21 CO 0.28 -3.80 0.23 0.45 -1.34 0.00 0.00 175.55 171.37 3ffs s SER 22 N 3.12 5.09 0.33 4.32 0.15 -1.26 -4.52 113.70 120.94 3ffs s SER 22 Ca 0.73 -2.31 0.25 0.00 0.70 0.00 0.00 55.95 55.33 3ffs s SER 22 Cb -0.34 -1.79 0.65 0.00 -1.71 0.00 0.00 66.02 62.83 3ffs s SER 22 CO 0.30 -0.45 1.71 -0.33 1.20 0.00 0.00 173.24 175.67 3ffs h GLU 23 N 7.64 0.00 -6.09 5.44 5.08 -1.92 -3.48 114.58 121.24 3ffs h GLU 23 Ca -0.09 0.00 -0.57 0.00 -1.00 0.00 0.00 59.36 57.70 3ffs h GLU 23 Cb 1.01 0.00 -0.10 0.00 0.50 0.00 0.00 28.75 30.16 3ffs h GLU 23 CO 0.67 0.00 -0.61 0.14 -1.00 0.00 0.00 179.01 178.21 3ffs s VAL 24 N -3.20 2.91 0.58 3.13 -7.23 -1.26 -5.12 120.40 110.21 3ffs s VAL 24 Ca 0.08 -1.90 0.04 0.00 -1.81 0.00 0.00 61.98 58.39 3ffs s VAL 24 Cb 0.09 -2.84 0.07 0.00 0.56 0.00 0.00 36.38 34.26 3ffs s VAL 24 CO 0.61 -0.24 0.80 -0.22 -0.31 0.00 0.00 175.10 175.74 3ffs s LEU 25 N -3.73 3.23 -0.04 1.32 1.98 -1.26 -4.88 118.68 115.30 3ffs s LEU 25 Ca 0.35 -0.40 -0.11 0.00 -2.89 0.00 0.00 54.13 51.07 3ffs s LEU 25 Cb -0.02 -2.27 -0.06 0.00 0.66 0.00 0.00 46.19 44.49 3ffs s LEU 25 CO 0.20 -1.31 0.52 -0.65 -1.89 0.00 0.00 176.35 173.22 3ffs h PRO 26 N 0.05 -0.39 -0.36 0.98 0.11 -1.93 -3.37 132.00 127.10 3ffs h PRO 26 Ca -0.37 0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.77 3ffs h PRO 26 Cb 1.28 0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.48 3ffs h PRO 26 CO 0.45 -0.26 0.00 0.54 -0.21 0.00 0.00 178.00 178.52 3ffs n ARG 27 N -4.57 0.57 -2.67 1.05 3.00 -1.26 -3.69 116.66 109.10 3ffs n ARG 27 Ca -0.05 0.00 -0.09 0.00 -0.01 0.00 0.00 57.85 57.70 3ffs n ARG 27 Cb 0.16 -1.18 0.03 0.00 0.00 0.00 0.00 32.46 31.47 3ffs n ARG 27 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.63 176.78 3ffs n GLU 28 N -0.06 1.16 -4.57 5.56 0.28 -1.26 -5.10 120.64 116.66 3ffs n GLU 28 Ca 0.00 -3.21 -0.27 0.00 -0.16 0.00 0.00 57.16 53.52 3ffs n GLU 28 Cb 0.09 -1.21 -0.14 0.00 1.43 0.00 0.00 31.44 31.61 3ffs n GLU 28 CO 0.00 0.00 0.00 0.14 -0.16 0.00 0.00 177.13 177.11 3ffs s VAL 29 N -3.04 1.94 -1.00 3.84 -7.23 -1.24 -4.65 120.40 109.02 3ffs s VAL 29 Ca 0.27 -1.46 -0.20 0.00 -1.81 0.00 0.00 61.98 58.78 3ffs s VAL 29 Cb 0.45 -1.70 0.10 0.00 0.56 0.00 0.00 36.38 35.79 3ffs s VAL 29 CO 0.03 0.16 1.31 -0.55 -0.31 0.00 0.00 175.10 175.74 3ffs s SER 30 N -1.57 6.61 0.43 4.85 0.15 -0.55 -4.82 113.70 118.81 3ffs s SER 30 Ca 0.10 -1.87 0.12 0.00 0.70 0.00 0.00 55.95 55.00 3ffs s SER 30 Cb -0.10 -2.48 1.01 0.00 -1.71 0.00 0.00 66.02 62.74 3ffs s SER 30 CO 0.03 -1.24 2.01 -0.07 1.20 0.00 0.00 173.24 175.17 3ffs h LEU 31 N 11.46 0.37 -1.73 3.45 3.38 -1.85 -3.38 115.31 127.01 3ffs h LEU 31 Ca 0.20 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 58.05 3ffs h LEU 31 Cb 1.00 -0.08 0.03 0.00 0.09 0.00 0.00 40.66 41.71 3ffs h LEU 31 CO 1.26 0.24 -0.16 -0.62 0.09 0.00 0.00 178.44 179.25 3ffs n GLU 32 N -4.47 0.00 -1.89 1.13 -0.58 -1.22 -4.45 120.64 109.15 3ffs n GLU 32 Ca 0.08 0.00 -0.00 0.00 -0.42 0.00 0.00 57.16 56.81 3ffs n GLU 32 Cb 0.29 -0.19 0.00 0.00 -0.57 0.00 0.00 31.44 30.97 3ffs n GLU 32 CO 0.00 0.00 0.00 -2.37 -0.48 0.00 0.00 177.13 174.28 3ffs n THR 33 N -0.15 0.00 -4.93 2.62 5.66 -0.28 -4.66 114.28 112.53 3ffs n THR 33 Ca 0.02 -0.09 -0.33 0.00 -3.05 0.00 0.00 64.05 60.61 3ffs n THR 33 Cb 0.07 0.13 -0.13 0.00 -1.55 0.00 0.00 70.33 68.85 3ffs n THR 33 CO 0.00 0.00 0.00 -0.54 -3.05 0.00 0.00 175.07 171.48 3ffs s LYS 34 N -2.01 2.51 -0.19 1.09 1.02 -1.26 -0.83 119.74 120.06 3ffs s LYS 34 Ca 0.04 -0.72 -0.15 0.00 0.02 0.00 0.00 55.97 55.16 3ffs s LYS 34 Cb -0.00 -2.36 -0.07 0.00 -0.52 0.00 0.00 37.83 34.88 3ffs s LYS 34 CO 0.01 0.59 -0.32 -0.11 -0.92 0.00 0.00 175.35 174.60 3ffs n LEU 35 N 2.39 1.84 -4.74 3.17 7.94 -0.45 -4.51 117.00 122.64 3ffs n LEU 35 Ca -0.17 0.31 -0.26 0.00 -1.11 0.00 0.00 56.01 54.78 3ffs n LEU 35 Cb 0.52 -0.72 -0.07 0.00 0.53 0.00 0.00 43.42 43.68 3ffs n LEU 35 CO 0.25 -0.02 -0.16 0.42 -1.11 0.00 0.00 177.39 176.77 3ffs s THR 36 N -2.71 2.10 0.22 1.96 -4.23 -1.22 -4.57 115.64 107.20 3ffs s THR 36 Ca -0.30 -1.75 0.11 0.00 -1.18 0.00 0.00 61.69 58.58 3ffs s THR 36 Cb 0.07 -2.84 0.11 0.00 1.34 0.00 0.00 72.50 71.18 3ffs s THR 36 CO 0.41 0.00 1.22 0.07 -0.54 0.00 0.00 174.62 175.78 3ffs h LYS 37 N 1.40 0.00 0.00 3.99 -0.00 -1.77 -2.90 116.57 117.29 3ffs h LYS 37 Ca -0.43 0.00 0.00 0.00 -0.00 0.00 0.00 60.65 60.22 3ffs h LYS 37 Cb 1.26 0.00 0.00 0.00 -0.00 0.00 0.00 32.23 33.49 3ffs h LYS 37 CO 0.71 0.00 0.00 0.27 -0.00 0.00 0.00 179.45 180.43 3ffs n ASN 38 N -2.11 0.00 -4.70 7.07 2.04 -1.26 -5.05 115.26 111.25 3ffs n ASN 38 Ca -0.01 0.00 -0.39 0.00 -0.44 0.00 0.00 54.58 53.74 3ffs n ASN 38 Cb 0.48 0.00 -0.06 0.00 -2.53 0.00 0.00 39.78 37.68 3ffs n ASN 38 CO 0.00 0.00 0.00 -0.69 -0.44 0.00 0.00 177.26 176.13 3ffs s VAL 39 N 0.00 5.12 0.11 3.53 1.01 -1.10 -5.05 120.40 124.02 3ffs s VAL 39 Ca 0.00 1.09 0.03 0.00 0.00 0.00 0.00 61.98 63.10 3ffs s VAL 39 Cb 0.00 -3.89 -0.04 0.00 0.00 0.00 0.00 36.38 32.46 3ffs s VAL 39 CO 0.00 0.25 0.12 -0.94 0.00 0.00 0.00 175.10 174.54 3ffs s SER 40 N 0.83 5.65 0.04 3.32 1.04 -1.26 -1.35 113.70 121.97 3ffs s SER 40 Ca 0.28 -0.01 0.06 0.00 0.48 0.00 0.00 55.95 56.77 3ffs s SER 40 Cb -0.16 -1.54 -0.02 0.00 0.10 0.00 0.00 66.02 64.40 3ffs s SER 40 CO 0.12 0.13 -0.18 -0.76 0.98 0.00 0.00 173.24 173.53 3ffs s LEU 41 N -2.68 2.17 0.29 2.42 1.43 -0.01 -4.86 118.68 117.44 3ffs s LEU 41 Ca 0.31 -0.50 0.22 0.00 -1.03 0.00 0.00 54.13 53.13 3ffs s LEU 41 Cb -0.11 -0.83 0.12 0.00 0.03 0.00 0.00 46.19 45.40 3ffs s LEU 41 CO 0.23 0.11 1.25 0.11 0.23 0.00 0.00 176.35 178.28 3ffs h LYS 42 N 4.87 0.00 -4.92 1.70 1.79 -0.71 -0.74 116.57 118.56 3ffs h LYS 42 Ca -0.41 0.00 -0.34 0.00 -2.18 0.00 0.00 60.65 57.72 3ffs h LYS 42 Cb 1.17 0.00 -0.22 0.00 -1.58 0.00 0.00 32.23 31.60 3ffs h LYS 42 CO 0.44 0.01 -0.76 0.96 -1.08 0.00 0.00 179.45 179.02 3ffs s ILE 43 N -3.30 0.80 -0.52 1.86 -4.36 -0.57 -3.43 121.20 111.68 3ffs s ILE 43 Ca 0.02 -1.15 0.03 0.00 -0.26 0.00 0.00 60.65 59.29 3ffs s ILE 43 Cb 0.08 -0.81 0.24 0.00 1.25 0.00 0.00 42.46 43.21 3ffs s ILE 43 CO 0.75 -0.29 1.04 -0.81 0.24 0.00 0.00 174.94 175.87 3ffs n PRO 44 N 1.43 1.90 -3.97 0.37 -0.05 -1.26 -4.47 135.00 128.95 3ffs n PRO 44 Ca -0.22 -0.96 -0.35 0.00 -0.05 0.00 0.00 63.50 61.92 3ffs n PRO 44 Cb 0.54 -1.59 -0.13 0.00 -0.05 0.00 0.00 33.50 32.27 3ffs n PRO 44 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 175.50 174.94 3ffs s LEU 45 N -0.92 3.14 -0.09 1.53 1.43 -1.26 -0.10 118.68 122.41 3ffs s LEU 45 Ca 0.17 -0.28 0.04 0.00 -1.03 0.00 0.00 54.13 53.04 3ffs s LEU 45 Cb 0.14 -1.81 -0.01 0.00 0.03 0.00 0.00 46.19 44.54 3ffs s LEU 45 CO 0.04 0.01 -0.23 0.27 0.23 0.00 0.00 176.35 176.68 3ffs s ILE 46 N 1.29 2.22 0.30 -0.59 -4.36 -1.08 -3.73 121.20 115.24 3ffs s ILE 46 Ca 0.04 -0.98 -0.22 0.00 -0.26 0.00 0.00 60.65 59.23 3ffs s ILE 46 Cb -0.15 -1.84 -0.09 0.00 1.25 0.00 0.00 42.46 41.63 3ffs s ILE 46 CO 0.00 0.56 0.85 -0.94 0.24 0.00 0.00 174.94 175.65 3ffs s SER 47 N 0.16 7.14 0.75 4.36 1.04 -0.95 -2.06 113.70 124.14 3ffs s SER 47 Ca -0.13 1.62 -0.12 0.00 0.48 0.00 0.00 55.95 57.81 3ffs s SER 47 Cb -0.16 -2.50 0.04 0.00 0.10 0.00 0.00 66.02 63.50 3ffs s SER 47 CO 0.07 -0.08 1.13 -0.55 0.98 0.00 0.00 173.24 174.79 3ffs s SER 48 N -1.75 5.06 -0.91 7.02 0.15 -1.17 -2.87 113.70 119.23 3ffs s SER 48 Ca 0.49 0.98 -0.02 0.00 0.70 0.00 0.00 55.95 58.10 3ffs s SER 48 Cb -0.16 -1.65 0.30 0.00 -1.71 0.00 0.00 66.02 62.79 3ffs s SER 48 CO 0.21 -1.57 2.05 0.00 1.20 0.00 0.00 173.24 175.13 3ffs n ALA 49 N -3.13 6.38 -2.77 5.45 0.00 -1.25 -4.13 120.51 121.05 3ffs n ALA 49 Ca 0.07 -4.19 -0.36 0.00 0.00 0.00 0.00 53.44 48.96 3ffs n ALA 49 Cb 0.59 -2.13 -0.08 0.00 0.00 0.00 0.00 19.45 17.82 3ffs n ALA 49 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 3ffs s MET 50 N -3.76 3.28 0.49 0.00 -1.94 -1.26 -4.62 119.30 111.49 3ffs s MET 50 Ca 0.48 -0.30 0.26 0.00 -1.71 0.00 0.00 55.69 54.42 3ffs s MET 50 Cb 0.33 -2.99 1.40 0.00 2.01 0.00 0.00 34.83 35.58 3ffs s MET 50 CO -0.28 0.67 1.76 0.38 -0.01 0.00 0.00 175.02 177.55 3ffs h ASP 51 N 5.30 0.00 -0.44 3.03 -0.00 -1.92 -0.52 116.42 121.87 3ffs h ASP 51 Ca -0.50 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 56.53 3ffs h ASP 51 Cb 1.20 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 40.53 3ffs h ASP 51 CO 0.58 0.00 0.00 1.07 -0.00 0.00 0.00 179.24 180.89 3ffs n THR 52 N -2.53 1.98 0.00 1.15 5.66 -1.26 -4.69 114.28 114.60 3ffs n THR 52 Ca -0.02 -1.44 0.00 0.00 -3.05 0.00 0.00 64.05 59.54 3ffs n THR 52 Cb 0.23 -0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.01 3ffs n THR 52 CO 0.00 0.00 0.00 0.55 -3.05 0.00 0.00 175.07 172.57 3ffs n VAL 53 N 0.34 0.00 -4.00 1.08 3.14 -0.21 -4.43 118.33 114.24 3ffs n VAL 53 Ca 0.22 0.00 -0.31 0.00 -2.96 0.00 0.00 64.34 61.29 3ffs n VAL 53 Cb 0.85 -0.69 -0.15 0.00 -1.06 0.00 0.00 33.84 32.79 3ffs n VAL 53 CO 0.00 0.00 0.00 -0.89 -6.46 0.00 0.00 176.83 169.48 3ffs s THR 54 N -1.95 2.12 0.00 1.55 2.01 -1.15 -4.54 115.64 113.68 3ffs s THR 54 Ca 0.00 -2.14 0.00 0.00 0.31 0.00 0.00 61.69 59.86 3ffs s THR 54 Cb 0.00 -2.52 0.00 0.00 0.01 0.00 0.00 72.50 69.99 3ffs s THR 54 CO 0.00 -0.52 0.00 1.21 -0.69 0.00 0.00 174.62 174.62 3ffs n GLU 55 N 4.34 3.95 0.00 4.92 4.07 -1.26 -3.79 120.64 132.86 3ffs n GLU 55 Ca 0.01 0.00 -0.17 0.00 -0.06 0.00 0.00 57.16 56.93 3ffs n GLU 55 Cb 0.42 0.00 -0.13 0.00 -0.06 0.00 0.00 31.44 31.67 3ffs n GLU 55 CO 0.00 0.00 0.00 1.12 -0.06 0.00 0.00 177.13 178.19 3ffs h HIS 56 N 0.00 0.38 0.00 4.31 2.07 -1.90 -3.07 115.15 116.94 3ffs h HIS 56 Ca 0.00 -0.25 0.00 0.00 -2.85 0.00 0.00 60.37 57.27 3ffs h HIS 56 Cb 0.00 -0.03 0.00 0.00 2.57 0.00 0.00 27.41 29.95 3ffs h HIS 56 CO 0.00 1.14 0.00 1.28 -3.07 0.00 0.00 177.93 177.28 3ffs n LEU 57 N -4.32 0.59 -0.12 6.12 4.32 -1.26 -1.88 117.00 120.45 3ffs n LEU 57 Ca -0.12 0.77 -0.22 0.00 -0.02 0.00 0.00 56.01 56.42 3ffs n LEU 57 Cb 0.66 -0.83 -0.12 0.00 -1.62 0.00 0.00 43.42 41.51 3ffs n LEU 57 CO 0.43 -0.95 -1.28 0.80 -1.22 0.00 0.00 177.39 175.17 3ffs n MET 58 N -2.29 0.64 -0.36 3.23 0.00 -1.21 -3.06 117.12 114.07 3ffs n MET 58 Ca -0.01 0.22 0.05 0.00 0.00 0.00 0.00 57.70 57.96 3ffs n MET 58 Cb 0.05 -1.54 0.21 0.00 0.00 0.00 0.00 33.22 31.93 3ffs n MET 58 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 3ffs h ALA 59 N -0.33 1.43 0.29 -5.12 0.00 -1.35 0.44 119.26 114.63 3ffs h ALA 59 Ca -0.59 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.32 3ffs h ALA 59 Cb 1.79 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 19.33 3ffs h ALA 59 CO -0.18 0.29 -0.29 0.28 0.00 0.00 0.00 179.25 179.35 3ffs h VAL 60 N 1.04 0.00 -0.96 0.00 2.07 -1.55 -1.22 116.25 115.64 3ffs h VAL 60 Ca 0.46 0.00 0.30 0.00 0.82 0.00 0.00 66.70 68.28 3ffs h VAL 60 Cb 0.36 0.00 -0.15 0.00 -1.52 0.00 0.00 31.29 29.97 3ffs h VAL 60 CO -0.23 0.00 0.41 1.23 0.02 0.00 0.00 177.57 179.00 3ffs h GLY 61 N -0.58 1.79 0.00 2.17 0.00 -1.34 -0.20 103.07 104.91 3ffs h GLY 61 Ca -0.04 -0.12 0.00 0.00 0.00 0.00 0.00 47.33 47.17 3ffs h GLY 61 CO -0.03 -0.49 0.00 1.03 0.00 0.00 0.00 176.54 177.04 3ffs n MET 62 N -5.17 0.00 0.26 4.80 2.81 0.10 -3.33 117.12 116.58 3ffs n MET 62 Ca 0.28 0.16 0.15 0.00 -1.81 0.00 0.00 57.70 56.48 3ffs n MET 62 Cb 0.90 -1.10 0.66 0.00 -0.71 0.00 0.00 33.22 32.97 3ffs n MET 62 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 3ffs h ALA 63 N -2.00 1.66 0.00 3.04 0.00 -0.97 0.43 119.26 121.42 3ffs h ALA 63 Ca 0.00 -0.00 -0.09 0.00 0.00 0.00 0.00 54.91 54.81 3ffs h ALA 63 Cb 0.00 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 3ffs h ALA 63 CO 0.00 -0.56 -0.45 -0.09 0.00 0.00 0.00 179.25 178.15 3ffs h ARG 64 N 0.00 0.00 -0.12 0.00 2.43 -1.12 0.47 114.38 116.04 3ffs h ARG 64 Ca 0.06 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.23 3ffs h ARG 64 Cb 1.06 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.61 3ffs h ARG 64 CO -0.00 0.45 0.00 1.28 -1.51 0.00 0.00 179.97 180.19 3ffs n LEU 65 N -3.50 2.99 0.00 3.80 4.77 0.15 -4.05 117.00 121.16 3ffs n LEU 65 Ca 0.00 -1.08 0.00 0.00 -0.03 0.00 0.00 56.01 54.90 3ffs n LEU 65 Cb 0.58 -0.07 0.00 0.00 -2.33 0.00 0.00 43.42 41.60 3ffs n LEU 65 CO 0.38 0.54 0.00 0.61 -1.33 0.00 0.00 177.39 177.59 3ffs n GLY 66 N 1.37 0.90 0.00 -0.72 0.00 -1.12 -4.67 105.19 100.96 3ffs n GLY 66 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.18 3ffs n GLY 66 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ffs n GLY 67 N -0.66 0.97 3.63 -0.02 0.00 -0.98 0.02 105.19 108.15 3ffs n GLY 67 Ca 0.00 -0.56 -0.03 0.00 0.00 0.00 0.00 46.02 45.43 3ffs n GLY 67 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 3ffs s ILE 68 N 3.88 0.00 -0.02 -0.61 2.07 -1.24 -4.19 121.20 121.08 3ffs s ILE 68 Ca 0.00 0.00 -0.01 0.00 -1.41 0.00 0.00 60.65 59.23 3ffs s ILE 68 Cb 0.00 -1.00 0.02 0.00 0.13 0.00 0.00 42.46 41.61 3ffs s ILE 68 CO 0.00 0.00 0.05 -0.83 -1.91 0.00 0.00 174.94 172.25 3ffs s GLY 69 N -1.87 0.01 -0.44 1.50 0.00 -1.26 -2.24 107.32 103.02 3ffs s GLY 69 Ca 0.11 0.23 -0.19 0.00 0.00 0.00 0.00 44.72 44.87 3ffs s GLY 69 CO -0.04 0.38 0.56 -0.42 0.00 0.00 0.00 173.10 173.59 3ffs s ILE 70 N 0.48 4.93 0.20 0.90 1.09 -1.14 -2.43 121.20 125.24 3ffs s ILE 70 Ca -0.04 -0.14 -0.30 0.00 -1.10 0.00 0.00 60.65 59.07 3ffs s ILE 70 Cb -0.05 -4.15 -0.09 0.00 -1.06 0.00 0.00 42.46 37.10 3ffs s ILE 70 CO -0.02 -0.56 1.38 -0.63 -0.10 0.00 0.00 174.94 175.02 3ffs s ILE 71 N 2.54 3.00 0.92 2.92 -1.09 -0.34 -3.95 121.20 125.20 3ffs s ILE 71 Ca 0.18 0.81 -0.12 0.00 -2.23 0.00 0.00 60.65 59.28 3ffs s ILE 71 Cb -0.16 -3.51 0.14 0.00 -1.58 0.00 0.00 42.46 37.35 3ffs s ILE 71 CO 0.16 0.11 1.10 -1.38 -1.23 0.00 0.00 174.94 173.70 3ffs s HIS 72 N 0.29 2.32 -0.36 3.97 -3.43 -1.25 -2.14 115.29 114.70 3ffs s HIS 72 Ca 0.60 1.14 0.09 0.00 -0.80 0.00 0.00 55.06 56.08 3ffs s HIS 72 Cb -0.39 -3.20 0.67 0.00 -1.43 0.00 0.00 32.58 28.23 3ffs s HIS 72 CO 0.38 -2.47 1.69 0.36 -2.00 0.00 0.00 174.74 172.70 3ffs n LYS 73 N -3.91 3.46 -2.26 -0.38 -0.00 -1.26 -4.70 118.16 109.10 3ffs n LYS 73 Ca 0.06 -2.73 -0.40 0.00 -0.00 0.00 0.00 58.31 55.24 3ffs n LYS 73 Cb 0.56 -2.12 0.03 0.00 -0.00 0.00 0.00 35.03 33.50 3ffs n LYS 73 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.40 175.69 3ffs n ASN 74 N -0.09 7.41 -3.63 -5.58 2.85 -1.26 -4.88 115.26 110.08 3ffs n ASN 74 Ca 0.37 -3.77 -0.03 0.00 -0.11 0.00 0.00 54.58 51.03 3ffs n ASN 74 Cb 1.28 -1.11 -0.05 0.00 1.24 0.00 0.00 39.78 41.15 3ffs n ASN 74 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 3ffs s MET 75 N -4.19 0.14 0.62 1.20 0.23 -1.26 -5.08 119.30 110.96 3ffs s MET 75 Ca 0.46 0.05 -0.18 0.00 -1.03 0.00 0.00 55.69 54.99 3ffs s MET 75 Cb 0.32 0.07 -0.05 0.00 -1.53 0.00 0.00 34.83 33.64 3ffs s MET 75 CO -0.28 -0.04 0.89 -0.40 -2.03 0.00 0.00 175.02 173.15 3ffs n ASP 76 N 0.71 0.40 -0.28 -1.18 5.75 -1.26 -4.59 116.55 116.10 3ffs n ASP 76 Ca -0.03 0.77 0.00 0.00 -0.01 0.00 0.00 54.79 55.52 3ffs n ASP 76 Cb 0.58 -1.36 0.04 0.00 -1.03 0.00 0.00 41.12 39.36 3ffs n ASP 76 CO 0.00 0.00 0.00 0.23 -0.11 0.00 0.00 177.20 177.32 3ffs n MET 77 N -1.00 -0.15 0.32 0.11 2.81 -1.26 -1.07 117.12 116.88 3ffs n MET 77 Ca 0.14 1.13 -0.17 0.00 -1.81 0.00 0.00 57.70 56.98 3ffs n MET 77 Cb 0.48 -1.67 -0.09 0.00 -0.71 0.00 0.00 33.22 31.23 3ffs n MET 77 CO 0.00 0.00 0.00 0.93 1.51 0.00 0.00 175.97 178.41 3ffs h GLU 78 N 0.00 -0.88 -0.74 0.03 4.39 -2.00 -2.16 114.58 113.22 3ffs h GLU 78 Ca 0.27 0.06 0.14 0.00 0.34 0.00 0.00 59.36 60.18 3ffs h GLU 78 Cb 0.45 0.20 -0.14 0.00 -0.10 0.00 0.00 28.75 29.17 3ffs h GLU 78 CO -0.73 -0.59 -0.21 1.03 -1.16 0.00 0.00 179.01 177.35 3ffs h SER 79 N -0.92 -0.77 0.06 1.42 0.87 -1.43 -1.07 113.55 111.72 3ffs h SER 79 Ca -0.07 0.23 -0.00 0.00 -1.23 0.00 0.00 61.79 60.72 3ffs h SER 79 Cb 0.76 0.49 0.00 0.00 -0.44 0.00 0.00 62.40 63.20 3ffs h SER 79 CO 0.05 -0.26 -0.03 -0.61 -0.53 0.00 0.00 176.83 175.45 3ffs h GLN 80 N -0.02 -0.08 -0.54 2.24 4.15 -1.43 -3.18 115.11 116.24 3ffs h GLN 80 Ca 0.34 0.01 0.15 0.00 0.77 0.00 0.00 58.65 59.92 3ffs h GLN 80 Cb 0.55 0.02 -0.02 0.00 0.21 0.00 0.00 27.48 28.23 3ffs h GLN 80 CO -0.77 0.09 0.39 0.28 -1.93 0.00 0.00 178.83 176.89 3ffs h VAL 81 N -0.24 0.76 -0.00 2.39 2.07 -0.53 0.25 116.25 120.94 3ffs h VAL 81 Ca -0.01 -0.02 -0.15 0.00 0.82 0.00 0.00 66.70 67.34 3ffs h VAL 81 Cb 0.21 0.69 -0.02 0.00 -1.52 0.00 0.00 31.29 30.65 3ffs h VAL 81 CO 0.01 0.01 -0.71 0.78 0.02 0.00 0.00 177.57 177.69 3ffs h ASN 82 N 0.06 0.03 0.43 0.57 2.35 -1.42 -1.90 115.58 115.70 3ffs h ASN 82 Ca 0.26 -0.02 -0.09 0.00 -0.55 0.00 0.00 56.30 55.90 3ffs h ASN 82 Cb 0.95 -0.01 -0.01 0.00 0.05 0.00 0.00 38.32 39.30 3ffs h ASN 82 CO -0.02 0.73 -0.44 -0.33 -1.65 0.00 0.00 177.43 175.72 3ffs h GLU 83 N 0.02 0.01 0.00 0.81 4.39 -0.50 -1.75 114.58 117.55 3ffs h GLU 83 Ca -0.01 -0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.69 3ffs h GLU 83 Cb 1.25 -0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.90 3ffs h GLU 83 CO 0.09 0.44 -0.00 0.28 -1.16 0.00 0.00 179.01 178.67 3ffs h VAL 84 N 0.01 1.47 -0.93 3.13 2.07 -1.32 -3.29 116.25 117.38 3ffs h VAL 84 Ca -0.00 -1.39 0.19 0.00 0.82 0.00 0.00 66.70 66.32 3ffs h VAL 84 Cb 0.78 2.41 -0.11 0.00 -1.52 0.00 0.00 31.29 32.85 3ffs h VAL 84 CO 0.06 0.36 0.50 -0.07 0.02 0.00 0.00 177.57 178.44 3ffs h LEU 85 N -0.59 0.59 -1.36 2.57 -0.00 -1.06 -0.59 115.31 114.86 3ffs h LEU 85 Ca -0.00 0.12 0.00 0.00 -0.00 0.00 0.00 57.88 57.99 3ffs h LEU 85 Cb 0.59 0.03 0.00 0.00 -0.00 0.00 0.00 40.66 41.28 3ffs h LEU 85 CO 0.00 0.17 0.00 0.11 -0.00 0.00 0.00 178.44 178.72 3ffs h LYS 86 N 0.61 0.00 0.01 1.13 1.57 -1.39 -3.14 116.57 115.35 3ffs h LYS 86 Ca 0.55 0.00 -0.42 0.00 -1.87 0.00 0.00 60.65 58.91 3ffs h LYS 86 Cb 0.91 0.00 -0.07 0.00 0.08 0.00 0.00 32.23 33.16 3ffs h LYS 86 CO -0.43 0.00 -2.43 0.28 -0.57 0.00 0.00 179.45 176.30 3ffs n VAL 87 N -2.41 1.53 -0.21 0.50 0.31 -0.28 -4.37 118.33 113.40 3ffs n VAL 87 Ca -0.00 -0.47 0.00 0.00 -0.01 0.00 0.00 64.34 63.86 3ffs n VAL 87 Cb 0.13 -1.67 0.00 0.00 -0.91 0.00 0.00 33.84 31.38 3ffs n VAL 87 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 3ffs n LYS 88 N -3.77 0.59 -2.66 5.55 4.76 -0.92 -3.88 118.16 117.82 3ffs n LYS 88 Ca -0.49 0.00 -0.03 0.00 -2.87 0.00 0.00 58.31 54.92 3ffs n LYS 88 Cb 0.93 -1.21 0.08 0.00 -1.84 0.00 0.00 35.03 33.00 3ffs n LYS 88 CO 0.00 0.00 0.00 -1.71 -1.37 0.00 0.00 177.40 174.32 3ffs n ASN 89 N 1.61 -1.21 -4.51 4.39 2.85 -1.24 -4.94 115.26 112.21 3ffs n ASN 89 Ca 0.00 -1.82 -0.35 0.00 -0.11 0.00 0.00 54.58 52.30 3ffs n ASN 89 Cb 0.29 1.12 -0.12 0.00 1.24 0.00 0.00 39.78 42.31 3ffs n ASN 89 CO 0.00 0.00 0.00 0.26 -2.11 0.00 0.00 177.26 175.41 3ffs s TRP 90 N 0.04 3.12 -0.36 1.20 0.52 -1.25 -4.89 118.94 117.33 3ffs s TRP 90 Ca 0.16 -0.25 0.14 0.00 0.02 0.00 0.00 56.10 56.16 3ffs s TRP 90 Cb 0.23 -2.15 0.38 0.00 -1.15 0.00 0.00 33.47 30.79 3ffs s TRP 90 CO -0.15 -0.16 0.80 0.44 0.02 0.00 0.00 176.95 177.91 3ffs n ILE 91 N 4.30 0.18 0.00 2.03 -0.00 -1.26 -5.06 119.36 119.56 3ffs n ILE 91 Ca -0.16 -4.10 0.00 0.00 -0.00 0.00 0.00 62.75 58.49 3ffs n ILE 91 Cb 0.52 0.03 0.00 0.00 -0.00 0.00 0.00 39.64 40.19 3ffs n ILE 91 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 3ffs n TYR 124 N 0.18 0.00 -1.06 4.28 9.36 -1.26 -5.32 117.16 123.33 3ffs n TYR 124 Ca 0.20 0.00 -0.15 0.00 3.32 0.00 0.00 57.90 61.27 3ffs n TYR 124 Cb 0.71 0.00 0.12 0.00 -0.63 0.00 0.00 39.34 39.54 3ffs n TYR 124 CO 0.00 0.00 0.00 -1.13 0.22 0.00 0.00 176.86 175.95 3ffs n SER 125 N -0.91 -0.90 -1.55 2.98 3.41 -1.26 -4.08 113.62 111.31 3ffs n SER 125 Ca 0.00 -1.01 -0.17 0.00 -0.26 0.00 0.00 58.87 57.43 3ffs n SER 125 Cb 0.00 -0.51 -0.05 0.00 -0.26 0.00 0.00 64.21 63.38 3ffs n SER 125 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 3ffs n ASN 126 N -3.74 -5.07 -4.74 4.04 2.85 -1.26 -4.83 115.26 102.52 3ffs n ASN 126 Ca 0.08 0.27 -0.36 0.00 -0.11 0.00 0.00 54.58 54.46 3ffs n ASN 126 Cb 0.30 -4.11 0.06 0.00 1.24 0.00 0.00 39.78 37.27 3ffs n ASN 126 CO 0.00 0.00 0.00 -1.61 -2.11 0.00 0.00 177.26 173.54 3ffs s GLU 127 N -3.95 2.68 -0.55 1.20 8.01 -1.26 -2.81 118.70 122.02 3ffs s GLU 127 Ca 0.00 1.96 -0.12 0.00 0.01 0.00 0.00 54.97 56.82 3ffs s GLU 127 Cb 0.00 -1.87 0.14 0.00 -4.31 0.00 0.00 34.13 28.08 3ffs s GLU 127 CO 0.00 -1.47 0.47 1.21 0.01 0.00 0.00 175.26 175.48 3ffs s ASN 128 N -1.50 6.02 0.16 -0.19 2.47 0.17 -4.78 114.94 117.27 3ffs s ASN 128 Ca 0.80 -2.00 0.11 0.00 0.42 0.00 0.00 52.86 52.19 3ffs s ASN 128 Cb -0.34 -2.11 -0.04 0.00 -1.45 0.00 0.00 41.25 37.30 3ffs s ASN 128 CO 0.38 -0.73 -0.25 -0.76 -3.72 0.00 0.00 177.10 172.02 3ffs s LEU 129 N 1.25 2.41 0.61 3.21 1.02 -1.26 -2.57 118.68 123.34 3ffs s LEU 129 Ca 0.07 -0.79 -0.09 0.00 0.02 0.00 0.00 54.13 53.34 3ffs s LEU 129 Cb -0.26 -1.23 -0.02 0.00 0.02 0.00 0.00 46.19 44.71 3ffs s LEU 129 CO -0.00 0.15 0.98 1.51 0.02 0.00 0.00 176.35 179.00 3ffs s ASP 130 N -2.37 5.90 0.00 2.29 -4.77 -0.46 -4.90 116.67 112.36 3ffs s ASP 130 Ca 0.18 1.11 0.00 0.00 -3.30 0.00 0.00 52.55 50.54 3ffs s ASP 130 Cb -0.09 -2.13 0.00 0.00 -1.09 0.00 0.00 42.92 39.61 3ffs s ASP 130 CO 0.08 -0.98 0.60 0.59 0.70 0.00 0.00 175.17 176.16 3ffs n ASN 131 N -2.70 0.00 -0.88 2.11 3.02 -1.26 -0.17 115.26 115.39 3ffs n ASN 131 Ca 0.05 0.17 0.09 0.00 -0.03 0.00 0.00 54.58 54.85 3ffs n ASN 131 Cb 0.56 -0.17 0.18 0.00 -0.61 0.00 0.00 39.78 39.74 3ffs n ASN 131 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 3ffs n LYS 132 N -1.10 2.31 -0.73 3.52 4.76 -1.26 -4.99 118.16 120.68 3ffs n LYS 132 Ca 0.00 -2.06 0.00 0.00 -2.87 0.00 0.00 58.31 53.38 3ffs n LYS 132 Cb 0.19 -1.38 0.00 0.00 -1.84 0.00 0.00 35.03 32.00 3ffs n LYS 132 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3ffs n GLY 133 N 1.02 0.55 3.23 0.72 0.00 0.76 -5.07 105.19 106.40 3ffs n GLY 133 Ca 0.15 -0.80 -0.32 0.00 0.00 0.00 0.00 46.02 45.05 3ffs n GLY 133 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3ffs s ARG 134 N -1.46 2.80 0.99 1.61 0.52 -1.25 -4.93 118.95 117.23 3ffs s ARG 134 Ca 0.00 -0.88 -0.17 0.00 -0.52 0.00 0.00 55.73 54.17 3ffs s ARG 134 Cb 0.00 -2.21 -0.10 0.00 0.52 0.00 0.00 34.95 33.16 3ffs s ARG 134 CO 0.00 0.26 -0.53 1.28 0.02 0.00 0.00 175.30 176.33 3ffs n LEU 135 N 3.29 -4.33 -4.76 2.53 4.77 -1.26 -1.35 117.00 115.89 3ffs n LEU 135 Ca -0.18 0.20 -0.35 0.00 -0.03 0.00 0.00 56.01 55.64 3ffs n LEU 135 Cb 0.53 -0.86 -0.08 0.00 -2.33 0.00 0.00 43.42 40.68 3ffs n LEU 135 CO 0.27 -5.17 -0.19 -0.13 -1.33 0.00 0.00 177.39 170.84 3ffs s ARG 136 N -2.45 3.96 0.06 3.23 1.81 -1.06 -4.54 118.95 119.96 3ffs s ARG 136 Ca 0.44 -0.21 0.05 0.00 -1.72 0.00 0.00 55.73 54.29 3ffs s ARG 136 Cb -0.17 -3.33 -0.03 0.00 -0.45 0.00 0.00 34.95 30.97 3ffs s ARG 136 CO 0.78 0.43 -0.14 0.08 -0.68 0.00 0.00 175.30 175.77 3ffs s VAL 137 N -0.02 1.08 0.27 3.52 1.01 -1.26 -4.38 120.40 120.63 3ffs s VAL 137 Ca 0.09 -1.17 0.11 0.00 0.00 0.00 0.00 61.98 61.02 3ffs s VAL 137 Cb -0.11 -1.02 -0.05 0.00 0.00 0.00 0.00 36.38 35.20 3ffs s VAL 137 CO -0.00 -0.14 -0.13 -0.83 0.00 0.00 0.00 175.10 174.00 3ffs s GLY 138 N -1.49 1.80 0.03 4.51 0.00 -1.02 -1.04 107.32 110.11 3ffs s GLY 138 Ca -0.01 -1.79 0.01 0.00 0.00 0.00 0.00 44.72 42.93 3ffs s GLY 138 CO 0.02 -1.87 -0.05 0.00 0.00 0.00 0.00 173.10 171.21 3ffs s ALA 139 N -2.42 0.34 0.08 3.20 0.00 0.27 -1.20 121.76 122.04 3ffs s ALA 139 Ca 0.30 -0.74 0.02 0.00 0.00 0.00 0.00 51.96 51.54 3ffs s ALA 139 Cb -0.06 0.13 -0.04 0.00 0.00 0.00 0.00 23.12 23.16 3ffs s ALA 139 CO 0.17 -0.14 0.12 0.00 0.00 0.00 0.00 175.76 175.91 3ffs s ALA 140 N -1.79 3.69 0.15 0.00 0.00 -0.91 0.81 121.76 123.70 3ffs s ALA 140 Ca -0.10 -0.99 -0.11 0.00 0.00 0.00 0.00 51.96 50.75 3ffs s ALA 140 Cb -0.07 -1.54 0.01 0.00 0.00 0.00 0.00 23.12 21.51 3ffs s ALA 140 CO -0.02 0.74 0.32 0.42 0.00 0.00 0.00 175.76 177.23 3ffs s ILE 141 N -1.46 0.08 -0.51 0.00 1.01 0.08 -4.40 121.20 115.99 3ffs s ILE 141 Ca 0.31 -1.12 0.07 0.00 0.00 0.00 0.00 60.65 59.90 3ffs s ILE 141 Cb -0.12 -1.60 0.20 0.00 0.01 0.00 0.00 42.46 40.95 3ffs s ILE 141 CO 0.24 -0.34 0.75 0.61 0.00 0.00 0.00 174.94 176.19 3ffs n GLY 142 N -0.21 -0.38 1.96 6.18 0.00 -1.26 -1.75 105.19 109.74 3ffs n GLY 142 Ca -0.11 0.35 -0.02 0.00 0.00 0.00 0.00 46.02 46.25 3ffs n GLY 142 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3ffs n VAL 143 N 2.68 -4.57 0.00 1.61 0.31 -1.26 -5.04 118.33 112.06 3ffs n VAL 143 Ca 0.17 0.14 0.00 0.00 -0.01 0.00 0.00 64.34 64.64 3ffs n VAL 143 Cb 0.57 -4.89 0.00 0.00 -0.91 0.00 0.00 33.84 28.61 3ffs n VAL 143 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 3ffs n GLU 145 N -0.76 0.00 0.05 5.55 1.02 -1.26 -5.05 120.64 120.19 3ffs n GLU 145 Ca 0.02 0.00 -0.11 0.00 -0.02 0.00 0.00 57.16 57.05 3ffs n GLU 145 Cb 0.29 0.00 -0.05 0.00 -0.02 0.00 0.00 31.44 31.66 3ffs n GLU 145 CO 0.00 0.00 0.00 0.82 1.18 0.00 0.00 177.13 179.13 3ffs h ILE 146 N 0.00 0.73 -0.73 -3.67 1.08 -1.99 -2.23 117.51 110.70 3ffs h ILE 146 Ca 0.00 0.00 0.16 0.00 -0.39 0.00 0.00 64.86 64.63 3ffs h ILE 146 Cb 0.00 0.73 -0.11 0.00 -3.07 0.00 0.00 36.82 34.37 3ffs h ILE 146 CO 0.00 0.00 0.17 -0.08 -0.69 0.00 0.00 178.15 177.55 3ffs h GLU 147 N -0.18 0.25 -0.36 2.37 4.81 -2.01 0.19 114.58 119.65 3ffs h GLU 147 Ca 0.04 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.25 3ffs h GLU 147 Cb 0.24 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.54 3ffs h GLU 147 CO -0.11 0.17 0.20 -0.09 -0.73 0.00 0.00 179.01 178.45 3ffs h ARG 148 N 0.26 0.50 -0.75 1.92 2.43 -1.97 -3.17 114.38 113.60 3ffs h ARG 148 Ca 0.41 -0.06 -0.04 0.00 -0.81 0.00 0.00 59.98 59.48 3ffs h ARG 148 Cb 0.69 -0.10 -0.03 0.00 -0.42 0.00 0.00 29.97 30.11 3ffs h ARG 148 CO -0.51 0.41 0.30 0.00 -1.51 0.00 0.00 179.97 178.66 3ffs h ALA 149 N 1.06 0.98 -0.47 2.80 0.00 -0.05 -2.53 119.26 121.05 3ffs h ALA 149 Ca 0.13 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 3ffs h ALA 149 Cb 0.05 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.53 3ffs h ALA 149 CO -0.02 0.61 0.21 1.57 0.00 0.00 0.00 179.25 181.61 3ffs h LYS 150 N 1.09 0.69 0.05 0.00 -0.00 -1.31 -2.94 116.57 114.15 3ffs h LYS 150 Ca 0.25 -0.12 0.02 0.00 -0.00 0.00 0.00 60.65 60.80 3ffs h LYS 150 Cb 0.22 -0.12 -0.03 0.00 -0.00 0.00 0.00 32.23 32.30 3ffs h LYS 150 CO -0.02 0.61 -0.15 -0.07 -0.00 0.00 0.00 179.45 179.82 3ffs h LEU 151 N 0.62 -0.42 -1.10 7.07 3.38 -1.43 -0.35 115.31 123.09 3ffs h LEU 151 Ca 0.16 0.06 0.05 0.00 0.09 0.00 0.00 57.88 58.24 3ffs h LEU 151 Cb 0.16 0.17 -0.06 0.00 0.09 0.00 0.00 40.66 41.02 3ffs h LEU 151 CO -0.02 -0.21 0.61 -0.07 0.09 0.00 0.00 178.44 178.84 3ffs h LEU 152 N -0.27 0.98 -0.46 1.67 3.38 -1.50 0.83 115.31 119.94 3ffs h LEU 152 Ca 0.04 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 3ffs h LEU 152 Cb 0.31 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.83 3ffs h LEU 152 CO -0.11 0.64 0.25 0.58 0.09 0.00 0.00 178.44 179.89 3ffs h VAL 153 N 1.12 1.17 -0.75 1.22 2.07 -1.29 -2.69 116.25 117.11 3ffs h VAL 153 Ca 0.39 -0.44 -0.03 0.00 0.82 0.00 0.00 66.70 67.44 3ffs h VAL 153 Cb 0.12 0.62 -0.03 0.00 -1.52 0.00 0.00 31.29 30.48 3ffs h VAL 153 CO -0.14 0.18 0.35 -0.33 0.02 0.00 0.00 177.57 177.65 3ffs h GLU 154 N 0.60 1.08 0.00 1.57 5.08 0.28 0.25 114.58 123.44 3ffs h GLU 154 Ca 0.16 -0.16 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3ffs h GLU 154 Cb 0.07 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 29.12 3ffs h GLU 154 CO -0.02 0.84 0.00 0.00 -1.00 0.00 0.00 179.01 178.83 3ffs n ALA 155 N -2.39 2.13 -1.98 3.43 0.00 0.16 -4.86 120.51 116.99 3ffs n ALA 155 Ca 0.06 -0.03 -0.04 0.00 0.00 0.00 0.00 53.44 53.43 3ffs n ALA 155 Cb 0.14 -1.09 0.02 0.00 0.00 0.00 0.00 19.45 18.51 3ffs n ALA 155 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3ffs n GLY 156 N 0.12 0.41 3.90 0.00 0.00 0.88 -4.67 105.19 105.82 3ffs n GLY 156 Ca 0.04 -0.13 -0.33 0.00 0.00 0.00 0.00 46.02 45.60 3ffs n GLY 156 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ffs s VAL 157 N -3.09 5.34 -0.05 1.61 0.11 -1.04 -4.94 120.40 118.34 3ffs s VAL 157 Ca 0.08 -0.07 -0.21 0.00 -2.93 0.00 0.00 61.98 58.85 3ffs s VAL 157 Cb -0.01 -3.58 -0.16 0.00 -1.53 0.00 0.00 36.38 31.10 3ffs s VAL 157 CO 0.17 0.25 0.86 0.44 -3.33 0.00 0.00 175.10 173.48 3ffs h ASP 158 N 3.54 -0.18 -3.48 3.54 5.19 -1.45 -3.45 116.42 120.13 3ffs h ASP 158 Ca -0.48 -0.36 -0.62 0.00 -0.62 0.00 0.00 57.03 54.95 3ffs h ASP 158 Cb 1.18 0.05 -0.33 0.00 0.18 0.00 0.00 39.33 40.41 3ffs h ASP 158 CO 0.70 0.39 -0.86 -0.69 -3.12 0.00 0.00 179.24 175.66 3ffs s VAL 159 N -3.36 1.74 -0.07 -1.35 1.01 -1.03 -3.94 120.40 113.39 3ffs s VAL 159 Ca -0.13 -0.84 -0.15 0.00 0.00 0.00 0.00 61.98 60.86 3ffs s VAL 159 Cb 0.00 -1.51 -0.05 0.00 0.00 0.00 0.00 36.38 34.82 3ffs s VAL 159 CO 0.47 0.49 0.39 -0.63 0.00 0.00 0.00 175.10 175.82 3ffs s ILE 160 N 0.35 5.15 -0.34 2.22 -1.09 -0.05 -0.56 121.20 126.88 3ffs s ILE 160 Ca -0.15 0.77 0.01 0.00 -2.23 0.00 0.00 60.65 59.06 3ffs s ILE 160 Cb -0.16 -3.70 0.09 0.00 -1.58 0.00 0.00 42.46 37.10 3ffs s ILE 160 CO 0.06 0.48 0.06 -0.69 -1.23 0.00 0.00 174.94 173.63 3ffs s VAL 161 N -0.34 2.65 -1.08 2.92 1.01 0.24 -2.33 120.40 123.46 3ffs s VAL 161 Ca 0.22 -2.02 -0.22 0.00 0.00 0.00 0.00 61.98 59.97 3ffs s VAL 161 Cb -0.15 -2.79 0.01 0.00 0.00 0.00 0.00 36.38 33.45 3ffs s VAL 161 CO 0.10 -0.47 1.71 -0.22 0.00 0.00 0.00 175.10 176.22 3ffs s LEU 162 N 1.05 3.44 0.20 3.92 0.20 0.12 -0.75 118.68 126.87 3ffs s LEU 162 Ca 0.05 -1.54 -0.13 0.00 0.69 0.00 0.00 54.13 53.19 3ffs s LEU 162 Cb -0.20 -2.57 -0.07 0.00 -0.43 0.00 0.00 46.19 42.91 3ffs s LEU 162 CO -0.05 -1.95 0.58 -0.62 -0.29 0.00 0.00 176.35 174.02 3ffs s ASP 163 N 5.73 6.75 -0.05 3.68 -1.08 -0.71 0.85 116.67 131.84 3ffs s ASP 163 Ca 0.57 1.06 -0.30 0.00 -0.52 0.00 0.00 52.55 53.36 3ffs s ASP 163 Cb -0.01 -2.28 0.11 0.00 -1.46 0.00 0.00 42.92 39.28 3ffs s ASP 163 CO -0.00 -0.00 0.94 -0.55 0.52 0.00 0.00 175.17 176.07 3ffs s SER 164 N -2.02 -0.35 0.04 -0.34 0.15 -1.23 -4.41 113.70 105.54 3ffs s SER 164 Ca 0.44 0.09 -0.23 0.00 0.70 0.00 0.00 55.95 56.94 3ffs s SER 164 Cb -0.13 0.35 -0.12 0.00 -1.71 0.00 0.00 66.02 64.40 3ffs s SER 164 CO 0.20 -0.53 1.35 0.00 1.20 0.00 0.00 173.24 175.46 3ffs h ALA 165 N 2.12 -1.18 -3.14 5.45 0.00 -1.93 -3.38 119.26 117.21 3ffs h ALA 165 Ca -0.20 -0.17 -0.70 0.00 0.00 0.00 0.00 54.91 53.84 3ffs h ALA 165 Cb 1.22 0.38 -0.31 0.00 0.00 0.00 0.00 17.79 19.07 3ffs h ALA 165 CO 0.30 -1.13 -0.58 -1.58 0.00 0.00 0.00 179.25 176.26 3ffs s HIS 166 N -4.82 3.37 0.12 0.00 5.65 -1.26 -4.81 115.29 113.54 3ffs s HIS 166 Ca -0.12 -1.83 -0.04 0.00 0.25 0.00 0.00 55.06 53.32 3ffs s HIS 166 Cb 0.02 -2.67 -0.11 0.00 -1.18 0.00 0.00 32.58 28.63 3ffs s HIS 166 CO 0.37 -0.84 1.29 0.78 -0.65 0.00 0.00 174.74 175.68 3ffs h GLY 167 N 8.17 0.41 -4.25 1.59 0.00 -1.26 -3.32 103.07 104.40 3ffs h GLY 167 Ca -0.20 -0.77 -0.31 0.00 0.00 0.00 0.00 47.33 46.06 3ffs h GLY 167 CO 0.65 0.68 0.53 1.57 0.00 0.00 0.00 176.54 179.97 3ffs n HIS 168 N -3.71 0.61 -3.57 5.60 -0.00 -1.26 -4.78 115.22 108.11 3ffs n HIS 168 Ca -0.07 -1.86 -0.21 0.00 0.46 0.00 0.00 57.72 56.04 3ffs n HIS 168 Cb 0.86 -1.77 -0.02 0.00 -0.12 0.00 0.00 29.99 28.94 3ffs n HIS 168 CO 0.00 0.00 0.00 0.45 0.46 0.00 0.00 176.34 177.25 3ffs s SER 169 N 1.91 5.01 -0.07 0.26 0.15 -1.25 -5.07 113.70 114.63 3ffs s SER 169 Ca 0.67 -0.81 -0.21 0.00 0.70 0.00 0.00 55.95 56.30 3ffs s SER 169 Cb 0.29 -0.41 -0.16 0.00 -1.71 0.00 0.00 66.02 64.03 3ffs s SER 169 CO -0.03 -0.74 0.80 0.25 1.20 0.00 0.00 173.24 174.72 3ffs h LEU 170 N 0.95 -0.12 0.00 3.45 6.46 -1.94 -3.14 115.31 120.98 3ffs h LEU 170 Ca -0.40 -0.45 0.00 0.00 -0.12 0.00 0.00 57.88 56.91 3ffs h LEU 170 Cb 1.27 0.03 0.00 0.00 -0.73 0.00 0.00 40.66 41.23 3ffs h LEU 170 CO 0.56 0.51 0.07 0.59 -0.62 0.00 0.00 178.44 179.55 3ffs n ASN 171 N -4.85 0.00 -0.09 1.25 4.13 -1.26 -0.91 115.26 113.54 3ffs n ASN 171 Ca -0.07 0.38 -0.11 0.00 1.68 0.00 0.00 54.58 56.46 3ffs n ASN 171 Cb 0.28 -0.38 -0.15 0.00 -1.54 0.00 0.00 39.78 37.98 3ffs n ASN 171 CO 0.00 0.00 0.00 -0.38 0.28 0.00 0.00 177.26 177.16 3ffs n ILE 172 N -1.37 1.45 0.22 2.41 2.08 -1.22 -3.15 119.36 119.77 3ffs n ILE 172 Ca 0.00 -0.82 -0.14 0.00 0.56 0.00 0.00 62.75 62.35 3ffs n ILE 172 Cb 0.07 -0.68 -0.08 0.00 -0.75 0.00 0.00 39.64 38.20 3ffs n ILE 172 CO 0.00 0.00 0.00 0.40 0.56 0.00 0.00 176.55 177.51 3ffs h ILE 173 N 0.00 0.57 -0.62 1.39 2.04 -0.97 -2.59 117.51 117.33 3ffs h ILE 173 Ca -0.50 -0.38 0.00 0.00 1.00 0.00 0.00 64.86 64.98 3ffs h ILE 173 Cb 2.17 0.75 -0.03 0.00 -0.74 0.00 0.00 36.82 38.97 3ffs h ILE 173 CO 0.03 0.07 0.39 0.08 0.00 0.00 0.00 178.15 178.72 3ffs h ARG 174 N -0.78 0.82 -0.36 2.37 0.11 -1.62 0.73 114.38 115.65 3ffs h ARG 174 Ca -0.06 -0.06 -0.08 0.00 0.10 0.00 0.00 59.98 59.89 3ffs h ARG 174 Cb 0.53 -0.18 -0.01 0.00 1.11 0.00 0.00 29.97 31.42 3ffs h ARG 174 CO 0.09 0.55 -0.08 1.15 0.10 0.00 0.00 179.97 181.78 3ffs h THR 175 N 0.84 1.28 -0.18 0.08 2.02 -1.61 -1.58 112.91 113.76 3ffs h THR 175 Ca 0.22 -1.15 -0.01 0.00 0.77 0.00 0.00 66.41 66.25 3ffs h THR 175 Cb -0.07 1.28 -0.01 0.00 -1.74 0.00 0.00 68.15 67.61 3ffs h THR 175 CO -0.05 0.38 0.06 0.25 0.37 0.00 0.00 175.52 176.53 3ffs h LEU 176 N 0.49 0.25 0.17 2.58 6.46 -0.89 -2.57 115.31 121.81 3ffs h LEU 176 Ca 0.09 -0.19 -0.00 0.00 -0.12 0.00 0.00 57.88 57.66 3ffs h LEU 176 Cb 0.59 -0.07 -0.01 0.00 -0.73 0.00 0.00 40.66 40.44 3ffs h LEU 176 CO 0.03 0.37 -0.23 0.11 -0.62 0.00 0.00 178.44 178.10 3ffs h LYS 177 N 0.12 -0.40 -1.04 1.25 1.57 -0.92 -2.43 116.57 114.71 3ffs h LYS 177 Ca 0.06 0.03 0.29 0.00 -1.87 0.00 0.00 60.65 59.15 3ffs h LYS 177 Cb 0.20 0.09 -0.06 0.00 0.08 0.00 0.00 32.23 32.55 3ffs h LYS 177 CO -0.00 -0.27 0.72 1.49 -0.57 0.00 0.00 179.45 180.82 3ffs h GLU 178 N -0.42 0.12 0.08 3.15 4.81 -1.27 0.28 114.58 121.33 3ffs h GLU 178 Ca -0.02 -0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.20 3ffs h GLU 178 Cb 0.38 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.73 3ffs h GLU 178 CO -0.06 0.08 -0.04 0.82 -0.73 0.00 0.00 179.01 179.08 3ffs h ILE 179 N 0.12 1.18 -0.80 2.32 2.04 -1.34 -3.25 117.51 117.79 3ffs h ILE 179 Ca 0.52 -1.02 0.07 0.00 1.00 0.00 0.00 64.86 65.43 3ffs h ILE 179 Cb 1.83 1.83 -0.06 0.00 -0.74 0.00 0.00 36.82 39.67 3ffs h ILE 179 CO -0.09 0.25 0.48 0.11 0.00 0.00 0.00 178.15 178.89 3ffs h LYS 180 N -0.58 0.83 -1.90 2.37 1.79 -0.46 -2.63 116.57 115.99 3ffs h LYS 180 Ca -0.01 -0.05 -0.24 0.00 -2.18 0.00 0.00 60.65 58.17 3ffs h LYS 180 Cb 0.49 -0.19 -0.09 0.00 -1.58 0.00 0.00 32.23 30.86 3ffs h LYS 180 CO 0.02 0.55 0.05 -1.13 -1.08 0.00 0.00 179.45 177.85 3ffs n SER 181 N -4.69 5.79 0.00 0.86 3.41 -0.83 -3.04 113.62 115.12 3ffs n SER 181 Ca 0.12 -2.74 0.00 0.00 -0.26 0.00 0.00 58.87 55.98 3ffs n SER 181 Cb 0.20 -1.23 0.00 0.00 -0.26 0.00 0.00 64.21 62.92 3ffs n SER 181 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3ffs n LYS 182 N 1.45 0.00 0.00 4.33 4.01 -1.01 -4.96 118.16 121.98 3ffs n LYS 182 Ca 0.31 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 58.11 3ffs n LYS 182 Cb 0.66 0.00 0.00 0.00 -0.51 0.00 0.00 35.03 35.18 3ffs n LYS 182 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 3ffs n MET 183 N 0.00 0.00 0.00 1.97 -0.00 -1.12 -5.03 117.12 112.94 3ffs n MET 183 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.70 57.70 3ffs n MET 183 Cb 0.27 0.00 0.00 0.00 -0.00 0.00 0.00 33.22 33.49 3ffs n MET 183 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 175.97 177.48 3ffs n ILE 185 N 0.00 0.00 -4.55 3.17 0.13 -1.26 -5.02 119.36 111.83 3ffs n ILE 185 Ca 0.00 0.00 -0.34 0.00 -1.10 0.00 0.00 62.75 61.31 3ffs n ILE 185 Cb 0.00 0.00 -0.11 0.00 -0.84 0.00 0.00 39.64 38.69 3ffs n ILE 185 CO 0.00 0.00 0.00 -1.81 2.80 0.00 0.00 176.55 177.54 3ffs s ASP 186 N -2.60 4.70 -0.05 9.51 1.11 -1.25 -5.04 116.67 123.05 3ffs s ASP 186 Ca 0.00 -0.05 0.01 0.00 0.18 0.00 0.00 52.55 52.69 3ffs s ASP 186 Cb 0.00 -1.38 0.02 0.00 1.07 0.00 0.00 42.92 42.63 3ffs s ASP 186 CO 0.00 0.30 -0.05 -0.69 1.18 0.00 0.00 175.17 175.91 3ffs s VAL 187 N -0.45 0.61 -0.07 -1.27 1.01 -1.26 -0.88 120.40 118.10 3ffs s VAL 187 Ca 0.07 -0.15 0.01 0.00 0.00 0.00 0.00 61.98 61.91 3ffs s VAL 187 Cb -0.12 -0.63 -0.03 0.00 0.00 0.00 0.00 36.38 35.61 3ffs s VAL 187 CO 0.02 0.24 -0.10 -0.63 0.00 0.00 0.00 175.10 174.64 3ffs s ILE 188 N 0.96 3.43 0.02 2.22 1.01 -0.99 -1.22 121.20 126.63 3ffs s ILE 188 Ca -0.10 -0.57 0.02 0.00 0.00 0.00 0.00 60.65 59.99 3ffs s ILE 188 Cb -0.14 -2.39 -0.04 0.00 0.01 0.00 0.00 42.46 39.90 3ffs s ILE 188 CO 0.00 0.58 0.01 -0.69 0.00 0.00 0.00 174.94 174.85 3ffs s VAL 189 N -0.60 4.21 -0.95 2.92 1.01 -1.21 0.15 120.40 125.94 3ffs s VAL 189 Ca 0.09 -0.66 -0.17 0.00 0.00 0.00 0.00 61.98 61.24 3ffs s VAL 189 Cb -0.11 -2.92 0.15 0.00 0.00 0.00 0.00 36.38 33.50 3ffs s VAL 189 CO 0.02 0.31 1.11 -0.83 0.00 0.00 0.00 175.10 175.71 3ffs s GLY 190 N -1.75 2.14 -0.11 4.51 0.00 0.25 -2.87 107.32 109.49 3ffs s GLY 190 Ca 0.22 -2.96 -0.08 0.00 0.00 0.00 0.00 44.72 41.90 3ffs s GLY 190 CO 0.13 1.88 0.15 0.70 0.00 0.00 0.00 173.10 175.96 3ffs n ASN 191 N 5.93 -1.18 -4.24 1.64 4.13 -0.99 -2.78 115.26 117.76 3ffs n ASN 191 Ca 0.24 0.85 -0.14 0.00 1.68 0.00 0.00 54.58 57.21 3ffs n ASN 191 Cb 0.48 -3.64 -0.10 0.00 -1.54 0.00 0.00 39.78 34.97 3ffs n ASN 191 CO 0.00 0.00 0.00 0.68 0.28 0.00 0.00 177.26 178.22 3ffs s VAL 192 N -0.41 1.13 0.00 2.41 -7.23 -0.89 -2.19 120.40 113.22 3ffs s VAL 192 Ca -0.17 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.00 3ffs s VAL 192 Cb 0.01 -1.77 0.00 0.00 0.56 0.00 0.00 36.38 35.18 3ffs s VAL 192 CO 0.47 -0.72 0.00 1.33 -0.31 0.00 0.00 175.10 175.87 3ffs n VAL 193 N -0.08 0.00 -2.07 1.32 0.24 -1.26 -3.36 118.33 113.13 3ffs n VAL 193 Ca -0.11 0.00 -0.38 0.00 -2.04 0.00 0.00 64.34 61.80 3ffs n VAL 193 Cb 0.60 -0.11 0.00 0.00 -1.47 0.00 0.00 33.84 32.87 3ffs n VAL 193 CO 0.00 0.00 0.00 0.28 -2.14 0.00 0.00 176.83 174.97 3ffs s THR 194 N -1.15 2.67 0.24 3.34 -1.32 -1.26 -4.46 115.64 113.69 3ffs s THR 194 Ca 0.00 0.55 0.05 0.00 -1.21 0.00 0.00 61.69 61.08 3ffs s THR 194 Cb 0.00 -3.30 -0.05 0.00 -1.51 0.00 0.00 72.50 67.64 3ffs s THR 194 CO 0.00 0.04 1.56 1.05 -2.21 0.00 0.00 174.62 175.06 3ffs h GLU 195 N 2.25 0.21 -0.96 7.08 9.09 -1.94 -3.17 114.58 127.14 3ffs h GLU 195 Ca -0.50 -0.15 0.18 0.00 0.05 0.00 0.00 59.36 58.94 3ffs h GLU 195 Cb 1.26 0.02 -0.10 0.00 -1.65 0.00 0.00 28.75 28.28 3ffs h GLU 195 CO 0.61 0.76 0.56 0.93 0.05 0.00 0.00 179.01 181.92 3ffs h GLU 196 N 0.15 0.71 -0.15 1.06 3.07 -1.93 -2.99 114.58 114.49 3ffs h GLU 196 Ca -0.01 -0.04 -0.10 0.00 -0.50 0.00 0.00 59.36 58.71 3ffs h GLU 196 Cb 1.12 -0.16 0.00 0.00 -0.84 0.00 0.00 28.75 28.87 3ffs h GLU 196 CO 0.09 0.47 -0.29 0.00 -1.40 0.00 0.00 179.01 177.88 3ffs h ALA 197 N 1.62 0.24 0.00 3.43 0.00 -1.95 -2.17 119.26 120.43 3ffs h ALA 197 Ca 0.54 -0.40 0.00 0.00 0.00 0.00 0.00 54.91 55.05 3ffs h ALA 197 Cb 0.82 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.57 3ffs h ALA 197 CO -0.38 0.25 0.22 2.41 0.00 0.00 0.00 179.25 181.76 3ffs n THR 198 N -4.39 0.81 -0.12 0.00 -1.04 -1.13 -2.15 114.28 106.24 3ffs n THR 198 Ca -0.06 0.71 -0.23 0.00 -2.04 0.00 0.00 64.05 62.42 3ffs n THR 198 Cb 0.47 -1.71 -0.08 0.00 -1.82 0.00 0.00 70.33 67.19 3ffs n THR 198 CO 0.00 0.00 0.00 1.17 -0.64 0.00 0.00 175.07 175.60 3ffs n LYS 199 N -1.99 0.57 0.00 -2.82 4.81 -0.87 -3.32 118.16 114.53 3ffs n LYS 199 Ca -0.01 0.30 0.03 0.00 -0.87 0.00 0.00 58.31 57.76 3ffs n LYS 199 Cb 0.24 -1.52 0.14 0.00 0.02 0.00 0.00 35.03 33.91 3ffs n LYS 199 CO 0.00 0.00 0.00 -1.91 1.17 0.00 0.00 177.40 176.66 3ffs n GLU 200 N -4.33 0.03 -0.13 1.64 2.13 -0.87 0.24 120.64 119.35 3ffs n GLU 200 Ca -0.41 0.33 -0.21 0.00 0.66 0.00 0.00 57.16 57.53 3ffs n GLU 200 Cb 0.76 -1.50 -0.11 0.00 0.27 0.00 0.00 31.44 30.86 3ffs n GLU 200 CO 0.00 0.00 0.00 1.28 -0.41 0.00 0.00 177.13 178.00 3ffs n LEU 201 N -1.42 2.59 0.40 4.31 4.77 -0.91 -3.97 117.00 122.76 3ffs n LEU 201 Ca 0.02 0.03 -0.17 0.00 -0.03 0.00 0.00 56.01 55.85 3ffs n LEU 201 Cb 0.06 -0.84 -0.08 0.00 -2.33 0.00 0.00 43.42 40.23 3ffs n LEU 201 CO 0.05 0.79 0.50 0.40 -1.33 0.00 0.00 177.39 177.81 3ffs h ILE 202 N -0.33 0.14 -0.69 -0.08 2.04 -1.51 -1.42 117.51 115.66 3ffs h ILE 202 Ca -0.59 -0.17 0.26 0.00 1.00 0.00 0.00 64.86 65.35 3ffs h ILE 202 Cb 1.76 0.17 -0.13 0.00 -0.74 0.00 0.00 36.82 37.89 3ffs h ILE 202 CO -0.20 0.01 0.25 1.21 0.00 0.00 0.00 178.15 179.43 3ffs n GLU 203 N -5.48 -0.05 -3.39 2.37 2.13 0.14 -1.74 120.64 114.62 3ffs n GLU 203 Ca -0.14 0.97 -0.26 0.00 0.66 0.00 0.00 57.16 58.39 3ffs n GLU 203 Cb 0.41 -1.68 -0.08 0.00 0.27 0.00 0.00 31.44 30.36 3ffs n GLU 203 CO 0.00 0.00 0.00 0.27 -0.41 0.00 0.00 177.13 176.99 3ffs n ASN 204 N -4.68 2.85 0.00 4.31 6.94 -1.23 -4.98 115.26 118.47 3ffs n ASN 204 Ca 0.23 -3.25 0.00 0.00 -0.02 0.00 0.00 54.58 51.54 3ffs n ASN 204 Cb 0.77 -0.67 0.00 0.00 -2.36 0.00 0.00 39.78 37.52 3ffs n ASN 204 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3ffs n GLY 205 N 1.07 1.59 3.76 4.83 0.00 -0.71 -4.68 105.19 111.05 3ffs n GLY 205 Ca 0.27 -0.48 -0.41 0.00 0.00 0.00 0.00 46.02 45.40 3ffs n GLY 205 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ffs s ALA 206 N -0.55 3.61 -0.12 4.61 0.00 -0.54 -4.84 121.76 123.93 3ffs s ALA 206 Ca 0.00 1.39 0.18 0.00 0.00 0.00 0.00 51.96 53.53 3ffs s ALA 206 Cb 0.00 -3.56 -0.27 0.00 0.00 0.00 0.00 23.12 19.29 3ffs s ALA 206 CO 0.00 -0.80 0.22 -0.25 0.00 0.00 0.00 175.76 174.92 3ffs n ASP 207 N 1.69 0.32 -3.65 0.00 10.43 -0.36 -4.71 116.55 120.28 3ffs n ASP 207 Ca 0.05 0.00 -0.11 0.00 2.57 0.00 0.00 54.79 57.29 3ffs n ASP 207 Cb 0.40 1.35 -0.05 0.00 1.84 0.00 0.00 41.12 44.66 3ffs n ASP 207 CO 0.00 0.00 0.00 -0.83 -1.07 0.00 0.00 177.20 175.30 3ffs s GLY 208 N -4.94 -0.27 -0.12 0.44 0.00 -1.23 -2.89 107.32 98.31 3ffs s GLY 208 Ca -0.09 0.05 -0.01 0.00 0.00 0.00 0.00 44.72 44.67 3ffs s GLY 208 CO 0.81 -0.21 -0.05 -0.42 0.00 0.00 0.00 173.10 173.23 3ffs s ILE 209 N -3.41 0.84 -0.07 0.90 1.01 -0.49 -3.29 121.20 116.68 3ffs s ILE 209 Ca 0.01 -0.25 -0.23 0.00 0.00 0.00 0.00 60.65 60.18 3ffs s ILE 209 Cb 0.01 -0.95 -0.04 0.00 0.01 0.00 0.00 42.46 41.49 3ffs s ILE 209 CO -0.09 0.27 0.67 -0.75 0.00 0.00 0.00 174.94 175.03 3ffs s LYS 210 N 1.77 4.42 -0.16 2.79 2.20 -1.14 -0.17 119.74 129.46 3ffs s LYS 210 Ca 0.04 0.82 -0.01 0.00 -0.36 0.00 0.00 55.97 56.46 3ffs s LYS 210 Cb -0.13 -3.45 -0.01 0.00 -1.51 0.00 0.00 37.83 32.73 3ffs s LYS 210 CO -0.07 0.08 -0.11 0.08 -0.36 0.00 0.00 175.35 174.96 3ffs s VAL 211 N 0.77 3.02 0.00 4.02 1.01 0.04 -2.10 120.40 127.16 3ffs s VAL 211 Ca 0.36 -0.65 0.00 0.00 0.00 0.00 0.00 61.98 61.69 3ffs s VAL 211 Cb -0.17 -2.30 0.00 0.00 0.00 0.00 0.00 36.38 33.90 3ffs s VAL 211 CO 0.17 0.50 0.00 0.61 0.00 0.00 0.00 175.10 176.38 3ffs n GLY 212 N 4.05 0.08 3.02 4.51 0.00 -1.21 -0.94 105.19 114.70 3ffs n GLY 212 Ca -0.18 0.62 -0.11 0.00 0.00 0.00 0.00 46.02 46.35 3ffs n GLY 212 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3ffs s ILE 213 N 0.00 0.30 0.00 -0.61 1.01 -1.26 -4.79 121.20 115.85 3ffs s ILE 213 Ca 0.00 -1.05 0.00 0.00 0.00 0.00 0.00 60.65 59.60 3ffs s ILE 213 Cb 0.00 -0.50 0.00 0.00 0.01 0.00 0.00 42.46 41.97 3ffs s ILE 213 CO 0.00 -0.49 0.00 -0.38 0.00 0.00 0.00 174.94 174.07 3ffs n ILE 223 N 1.42 0.00 -0.09 2.92 2.08 -1.26 -4.62 119.36 119.81 3ffs n ILE 223 Ca -0.23 0.00 -0.10 0.00 0.56 0.00 0.00 62.75 62.98 3ffs n ILE 223 Cb 0.55 0.00 -0.03 0.00 -0.75 0.00 0.00 39.64 39.41 3ffs n ILE 223 CO 0.00 0.00 0.00 0.58 0.56 0.00 0.00 176.55 177.69 3ffs h VAL 224 N 0.00 1.18 -0.01 1.39 2.07 -2.12 -3.32 116.25 115.45 3ffs h VAL 224 Ca 0.00 -0.56 0.00 0.00 0.82 0.00 0.00 66.70 66.96 3ffs h VAL 224 Cb 0.00 1.04 -0.01 0.00 -1.52 0.00 0.00 31.29 30.80 3ffs h VAL 224 CO 0.00 0.19 -0.06 0.00 0.02 0.00 0.00 177.57 177.72 3ffs h ALA 225 N 0.94 -0.52 0.00 1.67 0.00 -2.09 -3.47 119.26 115.80 3ffs h ALA 225 Ca 0.09 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.99 3ffs h ALA 225 Cb 0.20 0.58 0.00 0.00 0.00 0.00 0.00 17.79 18.57 3ffs h ALA 225 CO -0.01 -0.54 0.00 0.41 0.00 0.00 0.00 179.25 179.11 3ffs n GLY 226 N -1.05 0.44 3.15 0.00 0.00 -1.25 -5.05 105.19 101.44 3ffs n GLY 226 Ca -0.01 -0.99 -0.15 0.00 0.00 0.00 0.00 46.02 44.87 3ffs n GLY 226 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3ffs s VAL 227 N -2.00 0.89 0.00 1.61 1.01 -1.26 -5.08 120.40 115.57 3ffs s VAL 227 Ca 0.00 -1.48 0.00 0.00 0.00 0.00 0.00 61.98 60.50 3ffs s VAL 227 Cb 0.00 -1.17 0.00 0.00 0.00 0.00 0.00 36.38 35.21 3ffs s VAL 227 CO 0.00 -0.47 0.00 0.61 0.00 0.00 0.00 175.10 175.24 3ffs n GLY 228 N 0.85 3.96 2.96 4.51 0.00 -1.26 -5.00 105.19 111.22 3ffs n GLY 228 Ca -0.18 -1.50 -0.27 0.00 0.00 0.00 0.00 46.02 44.06 3ffs n GLY 228 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3ffs s VAL 229 N -2.00 1.20 0.18 1.61 1.01 -1.26 -5.07 120.40 116.07 3ffs s VAL 229 Ca 0.00 -0.42 -0.30 0.00 0.00 0.00 0.00 61.98 61.26 3ffs s VAL 229 Cb 0.00 -1.16 -0.17 0.00 0.00 0.00 0.00 36.38 35.05 3ffs s VAL 229 CO 0.00 0.39 0.72 -2.65 0.00 0.00 0.00 175.10 173.56 3ffs n PRO 230 N 4.70 0.29 -0.08 2.72 -0.02 -1.26 -4.53 135.00 136.81 3ffs n PRO 230 Ca -0.15 0.10 -0.07 0.00 -2.02 0.00 0.00 63.50 61.36 3ffs n PRO 230 Cb 0.50 -1.27 -0.00 0.00 -0.02 0.00 0.00 33.50 32.71 3ffs n PRO 230 CO 0.00 0.00 0.00 0.37 1.98 0.00 0.00 175.50 177.85 3ffs h GLN 231 N 1.63 0.20 -0.06 -0.52 5.75 -1.93 -1.74 115.11 118.45 3ffs h GLN 231 Ca -0.34 -0.01 0.02 0.00 -0.15 0.00 0.00 58.65 58.16 3ffs h GLN 231 Cb 1.42 -0.05 -0.02 0.00 1.07 0.00 0.00 27.48 29.90 3ffs h GLN 231 CO 0.60 0.13 -0.03 0.82 -2.65 0.00 0.00 178.83 177.70 3ffs h ILE 232 N 0.21 0.89 -0.25 2.39 1.08 -1.69 -0.89 117.51 119.25 3ffs h ILE 232 Ca 0.14 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.61 3ffs h ILE 232 Cb 0.12 0.89 -0.01 0.00 -3.07 0.00 0.00 36.82 34.75 3ffs h ILE 232 CO -0.15 0.00 0.17 0.74 -0.69 0.00 0.00 178.15 178.21 3ffs h THR 233 N -0.03 1.06 -0.06 -0.27 2.02 -1.08 -1.99 112.91 112.56 3ffs h THR 233 Ca 0.04 -0.12 -0.06 0.00 0.77 0.00 0.00 66.41 67.04 3ffs h THR 233 Cb 0.08 0.69 0.00 0.00 -1.74 0.00 0.00 68.15 67.19 3ffs h THR 233 CO -0.08 0.06 -0.21 0.00 0.37 0.00 0.00 175.52 175.66 3ffs h ALA 234 N 1.84 0.11 0.31 6.16 0.00 -0.52 0.09 119.26 127.25 3ffs h ALA 234 Ca 0.09 -0.39 -0.00 0.00 0.00 0.00 0.00 54.91 54.61 3ffs h ALA 234 Cb -0.03 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 3ffs h ALA 234 CO -0.02 0.08 -0.29 0.82 0.00 0.00 0.00 179.25 179.84 3ffs h ILE 235 N -0.25 0.39 -0.26 0.00 2.04 -1.10 -1.20 117.51 117.12 3ffs h ILE 235 Ca -0.01 0.00 0.06 0.00 1.00 0.00 0.00 64.86 65.91 3ffs h ILE 235 Cb 0.84 0.39 -0.08 0.00 -0.74 0.00 0.00 36.82 37.24 3ffs h ILE 235 CO 0.05 0.00 -0.33 -0.08 0.00 0.00 0.00 178.15 177.79 3ffs h GLU 236 N -0.62 -0.32 -0.95 2.37 4.81 -1.39 0.60 114.58 119.08 3ffs h GLU 236 Ca -0.02 0.02 0.09 0.00 -0.13 0.00 0.00 59.36 59.33 3ffs h GLU 236 Cb 0.56 0.07 -0.07 0.00 0.63 0.00 0.00 28.75 29.95 3ffs h GLU 236 CO -0.05 -0.21 0.61 0.87 -0.73 0.00 0.00 179.01 179.50 3ffs h LYS 237 N -0.33 0.97 -0.00 1.92 1.57 -0.95 -2.16 116.57 117.59 3ffs h LYS 237 Ca 0.13 -0.06 -0.10 0.00 -1.87 0.00 0.00 60.65 58.75 3ffs h LYS 237 Cb 0.54 -0.22 0.01 0.00 0.08 0.00 0.00 32.23 32.64 3ffs h LYS 237 CO -0.44 0.64 -0.39 0.00 -0.57 0.00 0.00 179.45 178.68 3ffs h SER 239 N -0.33 -1.55 -0.37 0.00 0.02 0.20 -2.55 113.55 108.97 3ffs h SER 239 Ca -0.05 0.16 0.11 0.00 -0.84 0.00 0.00 61.79 61.17 3ffs h SER 239 Cb 1.13 0.57 -0.01 0.00 0.14 0.00 0.00 62.40 64.23 3ffs h SER 239 CO 0.08 -0.54 0.72 0.77 -1.14 0.00 0.00 176.83 176.72 3ffs h SER 240 N -0.72 0.00 -0.37 3.07 4.64 -1.51 0.33 113.55 119.00 3ffs h SER 240 Ca -0.00 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 61.19 3ffs h SER 240 Cb 0.73 0.00 -0.08 0.00 -0.31 0.00 0.00 62.40 62.74 3ffs h SER 240 CO -0.29 0.00 0.02 1.33 -0.87 0.00 0.00 176.83 177.02 3ffs n VAL 241 N -3.12 2.50 -0.41 0.95 0.24 -0.97 -4.63 118.33 112.89 3ffs n VAL 241 Ca 0.07 -2.29 0.00 0.00 -2.04 0.00 0.00 64.34 60.08 3ffs n VAL 241 Cb 0.86 -0.30 0.00 0.00 -1.47 0.00 0.00 33.84 32.92 3ffs n VAL 241 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3ffs n ALA 242 N -0.84 0.00 0.14 2.33 0.00 -0.03 -4.61 120.51 117.50 3ffs n ALA 242 Ca 0.30 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.76 3ffs n ALA 242 Cb 1.03 0.00 0.06 0.00 0.00 0.00 0.00 19.45 20.53 3ffs n ALA 242 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 3ffs h SER 243 N 0.00 0.00 -0.35 0.00 0.87 -0.68 -3.36 113.55 110.02 3ffs h SER 243 Ca 0.00 0.00 0.03 0.00 -1.23 0.00 0.00 61.79 60.59 3ffs h SER 243 Cb 0.09 0.00 -0.04 0.00 -0.44 0.00 0.00 62.40 62.01 3ffs h SER 243 CO 0.00 0.56 -0.21 0.11 -0.53 0.00 0.00 176.83 176.76 3ffs h LYS 244 N 0.00 -0.01 -7.09 2.24 1.57 -1.88 -3.39 116.57 108.02 3ffs h LYS 244 Ca -0.01 0.00 -0.46 0.00 -1.87 0.00 0.00 60.65 58.31 3ffs h LYS 244 Cb 1.36 0.00 0.01 0.00 0.08 0.00 0.00 32.23 33.69 3ffs h LYS 244 CO 0.07 -0.00 0.37 -0.06 -0.57 0.00 0.00 179.45 179.26 3ffs s PHE 245 N -3.90 3.11 0.00 -1.35 0.40 -1.26 -4.88 117.98 110.10 3ffs s PHE 245 Ca -0.04 1.57 0.00 0.00 -0.60 0.00 0.00 56.93 57.86 3ffs s PHE 245 Cb 0.04 -2.98 0.00 0.00 0.51 0.00 0.00 43.02 40.59 3ffs s PHE 245 CO 0.22 -0.62 0.56 0.41 0.70 0.00 0.00 175.22 176.49 3ffs n GLY 246 N -0.50 1.03 3.54 4.36 0.00 -1.26 -4.76 105.19 107.60 3ffs n GLY 246 Ca 0.08 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.68 3ffs n GLY 246 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3ffs s ILE 247 N 1.33 4.88 0.27 -0.61 -1.09 -1.26 -4.58 121.20 120.15 3ffs s ILE 247 Ca 0.00 0.33 -0.30 0.00 -2.23 0.00 0.00 60.65 58.45 3ffs s ILE 247 Cb 0.00 -4.11 -0.09 0.00 -1.58 0.00 0.00 42.46 36.67 3ffs s ILE 247 CO 0.00 -0.42 1.06 -2.84 -1.23 0.00 0.00 174.94 171.50 3ffs s PRO 248 N 2.70 4.70 -0.04 2.79 0.02 -1.26 -4.56 135.00 139.35 3ffs s PRO 248 Ca 0.23 1.72 -0.10 0.00 0.02 0.00 0.00 61.00 62.87 3ffs s PRO 248 Cb -0.14 -3.21 -0.05 0.00 0.02 0.00 0.00 34.50 31.11 3ffs s PRO 248 CO 0.16 0.29 0.28 0.42 -0.33 0.00 0.00 177.00 177.82 3ffs s ILE 249 N -1.15 5.27 -0.15 2.83 1.09 -1.26 -1.39 121.20 126.44 3ffs s ILE 249 Ca 0.44 0.42 -0.02 0.00 -1.10 0.00 0.00 60.65 60.38 3ffs s ILE 249 Cb -0.30 -3.56 -0.02 0.00 -1.06 0.00 0.00 42.46 37.51 3ffs s ILE 249 CO 0.39 0.52 -0.08 -0.63 -0.10 0.00 0.00 174.94 175.04 3ffs s ILE 250 N -1.14 3.53 -0.65 2.92 1.01 0.76 0.43 121.20 128.06 3ffs s ILE 250 Ca 0.22 -0.49 -0.22 0.00 0.00 0.00 0.00 60.65 60.16 3ffs s ILE 250 Cb -0.14 -2.53 0.07 0.00 0.01 0.00 0.00 42.46 39.88 3ffs s ILE 250 CO 0.11 0.51 0.95 0.00 0.00 0.00 0.00 174.94 176.50 3ffs s ALA 251 N 0.37 3.14 -0.39 9.38 0.00 0.44 -0.78 121.76 133.91 3ffs s ALA 251 Ca -0.07 -1.85 -0.17 0.00 0.00 0.00 0.00 51.96 49.87 3ffs s ALA 251 Cb -0.15 -3.83 0.01 0.00 0.00 0.00 0.00 23.12 19.15 3ffs s ALA 251 CO 0.04 -2.74 0.41 0.34 0.00 0.00 0.00 175.76 173.82 3ffs s ASP 252 N 3.66 6.19 0.00 0.00 2.15 -0.12 -0.86 116.67 127.69 3ffs s ASP 252 Ca 0.22 -0.49 0.00 0.00 0.43 0.00 0.00 52.55 52.70 3ffs s ASP 252 Cb -0.17 -2.22 0.00 0.00 -0.30 0.00 0.00 42.92 40.23 3ffs s ASP 252 CO 0.10 -0.49 0.00 0.61 -0.17 0.00 0.00 175.17 175.22 3ffs n GLY 253 N 5.04 -1.56 2.04 2.66 0.00 -1.24 -4.22 105.19 107.91 3ffs n GLY 253 Ca -0.08 -1.56 -0.00 0.00 0.00 0.00 0.00 46.02 44.38 3ffs n GLY 253 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ffs n GLY 254 N -1.72 0.48 3.83 -0.02 0.00 -1.26 -5.02 105.19 101.48 3ffs n GLY 254 Ca 0.00 -0.07 -0.36 0.00 0.00 0.00 0.00 46.02 45.60 3ffs n GLY 254 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3ffs s ILE 255 N -1.97 4.67 0.00 -0.61 -1.09 -1.26 -4.98 121.20 115.97 3ffs s ILE 255 Ca 0.00 1.11 0.00 0.00 -2.23 0.00 0.00 60.65 59.53 3ffs s ILE 255 Cb 0.00 -3.80 0.00 0.00 -1.58 0.00 0.00 42.46 37.08 3ffs s ILE 255 CO 0.00 0.20 0.00 -1.14 -1.23 0.00 0.00 174.94 172.77 3ffs n ARG 256 N 0.70 0.00 -4.12 2.79 0.63 -1.26 -4.84 116.66 110.56 3ffs n ARG 256 Ca -0.03 0.00 -0.22 0.00 -0.92 0.00 0.00 57.85 56.68 3ffs n ARG 256 Cb 0.51 0.00 -0.06 0.00 0.45 0.00 0.00 32.46 33.37 3ffs n ARG 256 CO 0.00 0.00 0.00 0.71 -2.51 0.00 0.00 177.63 175.83 3ffs s TYR 257 N -0.83 2.86 0.54 -0.14 1.51 -1.26 -5.00 117.35 115.03 3ffs s TYR 257 Ca 0.00 -0.23 0.32 0.00 -1.01 0.00 0.00 57.07 56.15 3ffs s TYR 257 Cb 0.00 -1.45 1.49 0.00 -0.11 0.00 0.00 41.96 41.89 3ffs s TYR 257 CO 0.00 0.46 1.88 0.66 -1.11 0.00 0.00 175.55 177.44 3ffs h SER 258 N 1.58 0.00 -0.99 2.29 4.64 -1.93 -0.12 113.55 119.02 3ffs h SER 258 Ca -0.46 0.00 0.08 0.00 -0.47 0.00 0.00 61.79 60.95 3ffs h SER 258 Cb 1.25 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 63.27 3ffs h SER 258 CO 0.61 0.00 0.63 1.23 -0.87 0.00 0.00 176.83 178.43 3ffs h GLY 259 N 0.00 1.54 0.73 -0.77 0.00 -1.95 -2.87 103.07 99.75 3ffs h GLY 259 Ca 0.43 -0.45 0.09 0.00 0.00 0.00 0.00 47.33 47.40 3ffs h GLY 259 CO -0.00 0.28 0.59 -0.55 0.00 0.00 0.00 176.54 176.85 3ffs h ASP 260 N 1.10 0.86 -0.12 0.19 3.32 -1.41 -0.75 116.42 119.61 3ffs h ASP 260 Ca 0.45 0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.52 3ffs h ASP 260 Cb 0.26 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.65 3ffs h ASP 260 CO -0.20 0.51 0.08 0.40 -1.72 0.00 0.00 179.24 178.31 3ffs h ILE 261 N 0.95 1.04 0.13 0.35 2.04 -1.66 -0.04 117.51 120.32 3ffs h ILE 261 Ca 0.42 -0.08 0.01 0.00 1.00 0.00 0.00 64.86 66.20 3ffs h ILE 261 Cb 0.35 0.89 -0.04 0.00 -0.74 0.00 0.00 36.82 37.27 3ffs h ILE 261 CO -0.18 0.04 -0.49 1.23 0.00 0.00 0.00 178.15 178.75 3ffs h GLY 262 N 0.15 -1.17 -0.07 5.37 0.00 -1.21 -2.11 103.07 104.03 3ffs h GLY 262 Ca 0.04 0.64 0.11 0.00 0.00 0.00 0.00 47.33 48.13 3ffs h GLY 262 CO -0.01 -0.28 -0.09 0.50 0.00 0.00 0.00 176.54 176.65 3ffs h LYS 263 N -0.72 0.04 -0.96 4.80 1.57 -1.20 -1.82 116.57 118.28 3ffs h LYS 263 Ca -0.01 -0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.77 3ffs h LYS 263 Cb 0.71 -0.01 -0.05 0.00 0.08 0.00 0.00 32.23 32.97 3ffs h LYS 263 CO -0.26 0.02 0.59 0.00 -0.57 0.00 0.00 179.45 179.24 3ffs h ALA 264 N 1.55 1.22 0.21 3.86 0.00 -0.65 -2.90 119.26 122.55 3ffs h ALA 264 Ca 0.28 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 3ffs h ALA 264 Cb 0.43 -0.39 0.00 0.00 0.00 0.00 0.00 17.79 17.84 3ffs h ALA 264 CO -0.55 0.66 -0.10 -0.07 0.00 0.00 0.00 179.25 179.20 3ffs h LEU 265 N 1.32 -0.24 -0.59 0.00 3.38 -1.20 -2.98 115.31 115.00 3ffs h LEU 265 Ca 0.35 -0.12 0.20 0.00 0.09 0.00 0.00 57.88 58.40 3ffs h LEU 265 Cb -0.08 0.06 -0.06 0.00 0.09 0.00 0.00 40.66 40.67 3ffs h LEU 265 CO -0.07 0.27 0.38 0.00 0.09 0.00 0.00 178.44 179.12 3ffs n ALA 266 N -2.71 0.58 0.09 1.53 0.00 -0.70 0.12 120.51 119.43 3ffs n ALA 266 Ca -0.05 0.36 0.06 0.00 0.00 0.00 0.00 53.44 53.82 3ffs n ALA 266 Cb 0.17 -0.45 -0.01 0.00 0.00 0.00 0.00 19.45 19.17 3ffs n ALA 266 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3ffs h VAL 267 N 0.00 0.27 0.00 0.00 2.07 -1.63 -3.40 116.25 113.57 3ffs h VAL 267 Ca 0.37 -1.49 0.00 0.00 0.82 0.00 0.00 66.70 66.40 3ffs h VAL 267 Cb 1.21 1.85 0.00 0.00 -1.52 0.00 0.00 31.29 32.83 3ffs h VAL 267 CO -0.19 0.16 0.00 0.61 0.02 0.00 0.00 177.57 178.17 3ffs n GLY 268 N 1.25 0.25 3.75 2.17 0.00 0.33 -4.57 105.19 108.37 3ffs n GLY 268 Ca -0.03 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.58 3ffs n GLY 268 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ffs s ALA 269 N 0.00 3.45 0.09 4.61 0.00 -1.12 -4.59 121.76 124.20 3ffs s ALA 269 Ca 0.00 1.01 0.05 0.00 0.00 0.00 0.00 51.96 53.02 3ffs s ALA 269 Cb 0.00 -3.41 -0.23 0.00 0.00 0.00 0.00 23.12 19.47 3ffs s ALA 269 CO 0.00 -0.39 1.17 0.77 0.00 0.00 0.00 175.76 177.31 3ffs h SER 270 N 4.64 0.11 -4.41 0.00 0.02 -0.34 -3.38 113.55 110.18 3ffs h SER 270 Ca -0.46 -0.13 -0.13 0.00 -0.84 0.00 0.00 61.79 60.24 3ffs h SER 270 Cb 1.22 -0.04 -0.22 0.00 0.14 0.00 0.00 62.40 63.50 3ffs h SER 270 CO 0.72 1.10 -0.29 -0.94 -1.14 0.00 0.00 176.83 176.28 3ffs s SER 271 N -6.76 -0.28 -0.12 3.07 1.04 -1.16 -4.66 113.70 104.83 3ffs s SER 271 Ca -0.01 0.40 0.01 0.00 0.48 0.00 0.00 55.95 56.83 3ffs s SER 271 Cb 0.09 0.52 -0.01 0.00 0.10 0.00 0.00 66.02 66.72 3ffs s SER 271 CO 0.84 -0.28 -0.16 0.54 0.98 0.00 0.00 173.24 175.15 3ffs s VAL 272 N -0.56 2.77 -0.14 5.02 0.11 0.85 -0.42 120.40 128.03 3ffs s VAL 272 Ca -0.07 -0.77 -0.18 0.00 -2.93 0.00 0.00 61.98 58.04 3ffs s VAL 272 Cb -0.04 -2.14 -0.04 0.00 -1.53 0.00 0.00 36.38 32.64 3ffs s VAL 272 CO 0.02 0.54 0.47 -0.32 -3.33 0.00 0.00 175.10 172.48 3ffs s MET 273 N 0.31 4.30 -0.21 1.54 1.75 -0.04 -2.65 119.30 124.29 3ffs s MET 273 Ca -0.12 0.40 -0.06 0.00 -1.25 0.00 0.00 55.69 54.66 3ffs s MET 273 Cb -0.16 -3.47 -0.03 0.00 2.84 0.00 0.00 34.83 34.02 3ffs s MET 273 CO 0.06 0.09 0.02 0.96 -0.65 0.00 0.00 175.02 175.51 3ffs s ILE 274 N 0.85 4.08 0.00 10.11 -4.36 -0.87 -3.61 121.20 127.38 3ffs s ILE 274 Ca 0.25 -0.26 0.00 0.00 -0.26 0.00 0.00 60.65 60.37 3ffs s ILE 274 Cb -0.15 -2.86 0.00 0.00 1.25 0.00 0.00 42.46 40.70 3ffs s ILE 274 CO 0.10 0.40 0.00 0.61 0.24 0.00 0.00 174.94 176.29 3ffs n GLY 275 N 4.43 -0.10 0.00 6.27 0.00 -1.26 -3.03 105.19 111.51 3ffs n GLY 275 Ca -0.17 0.00 0.09 0.00 0.00 0.00 0.00 46.02 45.94 3ffs n GLY 275 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3ffs n SER 276 N -0.89 0.00 0.09 1.61 3.41 -1.26 -2.11 113.62 114.47 3ffs n SER 276 Ca 0.00 -0.40 0.12 0.00 -0.26 0.00 0.00 58.87 58.33 3ffs n SER 276 Cb 0.00 -0.09 0.23 0.00 -0.26 0.00 0.00 64.21 64.09 3ffs n SER 276 CO 0.00 0.00 0.00 0.40 -0.16 0.00 0.00 175.04 175.28 3ffs h ILE 277 N 0.00 0.00 0.00 -1.33 2.04 -1.88 -3.35 117.51 112.99 3ffs h ILE 277 Ca 0.00 -0.58 0.00 0.00 1.00 0.00 0.00 64.86 65.28 3ffs h ILE 277 Cb 0.05 1.32 0.00 0.00 -0.74 0.00 0.00 36.82 37.45 3ffs h ILE 277 CO 0.00 0.00 -1.58 0.18 0.00 0.00 0.00 178.15 176.75 3ffs n LEU 278 N -2.30 0.04 -0.02 1.44 4.77 -0.90 -4.85 117.00 115.19 3ffs n LEU 278 Ca 0.04 -0.03 -0.01 0.00 -0.03 0.00 0.00 56.01 55.98 3ffs n LEU 278 Cb 0.45 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.54 3ffs n LEU 278 CO 0.35 0.01 0.06 0.00 -1.33 0.00 0.00 177.39 176.47 3ffs n ALA 279 N -1.95 -0.03 -1.30 -1.18 0.00 -1.15 -2.18 120.51 112.72 3ffs n ALA 279 Ca -0.02 0.05 -0.29 0.00 0.00 0.00 0.00 53.44 53.17 3ffs n ALA 279 Cb 0.36 0.02 0.13 0.00 0.00 0.00 0.00 19.45 19.95 3ffs n ALA 279 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3ffs n GLY 280 N -1.01 5.25 3.91 0.00 0.00 -1.26 -4.55 105.19 107.53 3ffs n GLY 280 Ca 0.00 -1.75 -0.27 0.00 0.00 0.00 0.00 46.02 44.00 3ffs n GLY 280 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3ffs s THR 281 N -4.11 5.01 0.53 2.61 -4.23 -0.92 0.95 115.64 115.48 3ffs s THR 281 Ca 0.61 -0.02 0.24 0.00 -1.18 0.00 0.00 61.69 61.33 3ffs s THR 281 Cb 0.49 -3.79 0.37 0.00 1.34 0.00 0.00 72.50 70.91 3ffs s THR 281 CO 0.04 -0.50 2.02 -0.08 -0.54 0.00 0.00 174.62 175.57 3ffs h GLU 282 N 1.13 0.00 -0.17 3.99 4.81 -1.54 0.26 114.58 123.06 3ffs h GLU 282 Ca -0.48 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.75 3ffs h GLU 282 Cb 1.20 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.58 3ffs h GLU 282 CO 0.64 0.00 0.00 0.39 -0.73 0.00 0.00 179.01 179.31 3ffs n GLU 283 N -4.36 1.45 -3.92 1.92 4.71 -1.26 -4.88 120.64 114.29 3ffs n GLU 283 Ca 0.07 -0.69 -0.21 0.00 -0.01 0.00 0.00 57.16 56.32 3ffs n GLU 283 Cb 0.51 -1.22 -0.03 0.00 -1.01 0.00 0.00 31.44 29.70 3ffs n GLU 283 CO 0.00 0.00 0.00 -1.54 0.09 0.00 0.00 177.13 175.68 3ffs s SER 284 N -1.18 5.86 0.13 1.62 1.04 0.08 -3.36 113.70 117.89 3ffs s SER 284 Ca 0.19 -0.15 -0.01 0.00 0.48 0.00 0.00 55.95 56.46 3ffs s SER 284 Cb 0.10 -1.50 0.27 0.00 0.10 0.00 0.00 66.02 64.99 3ffs s SER 284 CO 0.14 -0.15 0.67 -2.65 0.98 0.00 0.00 173.24 172.23 3ffs n PRO 285 N -1.36 -0.04 -0.34 4.02 -0.02 -1.26 -4.82 135.00 131.19 3ffs n PRO 285 Ca -0.06 0.65 -0.21 0.00 -2.02 0.00 0.00 63.50 61.85 3ffs n PRO 285 Cb 0.58 -1.01 0.20 0.00 -0.02 0.00 0.00 33.50 33.25 3ffs n PRO 285 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3ffs n GLY 286 N -1.24 -3.51 3.38 -1.23 0.00 -1.26 -5.08 105.19 96.25 3ffs n GLY 286 Ca 0.09 -1.34 -0.30 0.00 0.00 0.00 0.00 46.02 44.47 3ffs n GLY 286 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3ffs s GLU 287 N -4.56 1.75 0.10 1.61 0.41 -1.26 -5.09 118.70 111.66 3ffs s GLU 287 Ca 0.48 -1.15 -0.28 0.00 -0.41 0.00 0.00 54.97 53.61 3ffs s GLU 287 Cb -0.07 -2.00 -0.06 0.00 -1.78 0.00 0.00 34.13 30.22 3ffs s GLU 287 CO 0.39 0.50 0.88 0.15 -0.49 0.00 0.00 175.26 176.69 3ffs s LYS 288 N -1.50 4.62 -0.27 1.61 1.02 -1.26 -4.45 119.74 119.52 3ffs s LYS 288 Ca 0.13 1.29 -0.20 0.00 0.02 0.00 0.00 55.97 57.21 3ffs s LYS 288 Cb -0.10 -3.36 0.07 0.00 -0.52 0.00 0.00 37.83 33.92 3ffs s LYS 288 CO 0.04 0.28 0.69 -1.83 -0.92 0.00 0.00 175.35 173.60 3ffs s GLU 289 N -0.15 0.76 -0.20 1.68 -1.05 -1.21 -5.05 118.70 113.48 3ffs s GLU 289 Ca 0.43 1.08 -0.14 0.00 -0.15 0.00 0.00 54.97 56.20 3ffs s GLU 289 Cb -0.22 0.27 -0.04 0.00 -0.44 0.00 0.00 34.13 33.69 3ffs s GLU 289 CO 0.27 -0.12 0.29 -0.51 0.95 0.00 0.00 175.26 176.14 3ffs s LEU 290 N 0.96 4.18 -0.22 1.83 1.02 -1.26 -2.50 118.68 122.69 3ffs s LEU 290 Ca -0.05 0.41 -0.02 0.00 0.02 0.00 0.00 54.13 54.49 3ffs s LEU 290 Cb -0.05 -2.35 0.07 0.00 0.02 0.00 0.00 46.19 43.87 3ffs s LEU 290 CO -0.09 0.03 0.03 0.27 0.02 0.00 0.00 176.35 176.61 3ffs s ILE 291 N 0.91 0.76 -0.10 -0.59 -4.36 -1.21 -5.01 121.20 111.59 3ffs s ILE 291 Ca 0.15 -0.81 -0.07 0.00 -0.26 0.00 0.00 60.65 59.66 3ffs s ILE 291 Cb -0.14 -1.27 0.03 0.00 1.25 0.00 0.00 42.46 42.33 3ffs s ILE 291 CO 0.05 -0.26 0.15 0.61 0.24 0.00 0.00 174.94 175.72 3ffs n GLY 292 N 4.95 -3.43 5.00 6.27 0.00 -1.26 -4.06 105.19 112.66 3ffs n GLY 292 Ca -0.08 1.06 0.00 0.00 0.00 0.00 0.00 46.02 46.99 3ffs n GLY 292 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3ffs n ASP 293 N 2.01 0.00 -4.89 1.61 5.68 -1.26 -4.78 116.55 114.93 3ffs n ASP 293 Ca -0.25 0.00 -0.34 0.00 -0.50 0.00 0.00 54.79 53.71 3ffs n ASP 293 Cb 0.38 0.00 -0.05 0.00 -1.14 0.00 0.00 41.12 40.31 3ffs n ASP 293 CO 0.00 0.00 0.00 0.42 -1.33 0.00 0.00 177.20 176.29 3ffs s THR 294 N 0.00 5.30 -0.03 2.12 -4.23 -1.26 -5.10 115.64 112.44 3ffs s THR 294 Ca 0.00 0.07 -0.15 0.00 -1.18 0.00 0.00 61.69 60.43 3ffs s THR 294 Cb 0.00 -3.58 -0.05 0.00 1.34 0.00 0.00 72.50 70.21 3ffs s THR 294 CO 0.00 0.29 0.41 -0.69 -0.54 0.00 0.00 174.62 174.09 3ffs s VAL 295 N -1.38 5.07 0.42 2.29 1.01 -1.26 -3.31 120.40 123.25 3ffs s VAL 295 Ca 0.30 0.84 0.03 0.00 0.00 0.00 0.00 61.98 63.16 3ffs s VAL 295 Cb -0.13 -3.73 -0.04 0.00 0.00 0.00 0.00 36.38 32.49 3ffs s VAL 295 CO 0.19 0.52 0.06 -0.31 0.00 0.00 0.00 175.10 175.56 3ffs s TYR 296 N -0.65 1.95 0.08 5.22 1.51 -1.04 -1.43 117.35 122.99 3ffs s TYR 296 Ca 0.24 -1.03 0.00 0.00 -1.01 0.00 0.00 57.07 55.27 3ffs s TYR 296 Cb -0.16 -1.41 0.00 0.00 -0.11 0.00 0.00 41.96 40.28 3ffs s TYR 296 CO 0.12 0.03 0.00 1.63 -1.11 0.00 0.00 175.55 176.22 3ffs n LYS 297 N -0.97 0.00 -4.16 -0.62 5.02 -1.26 -3.31 118.16 112.85 3ffs n LYS 297 Ca -0.09 0.00 -0.18 0.00 -2.02 0.00 0.00 58.31 56.02 3ffs n LYS 297 Cb 0.66 -0.42 -0.12 0.00 -0.02 0.00 0.00 35.03 35.14 3ffs n LYS 297 CO 0.00 0.00 0.00 0.50 -0.52 0.00 0.00 177.40 177.38 3ffs s ARG 334 N -2.00 0.78 -0.02 1.97 3.52 -1.26 -4.31 118.95 117.64 3ffs s ARG 334 Ca 0.00 -0.92 -0.23 0.00 -0.13 0.00 0.00 55.73 54.45 3ffs s ARG 334 Cb 0.00 -0.76 0.05 0.00 -1.56 0.00 0.00 34.95 32.67 3ffs s ARG 334 CO 0.00 0.17 0.51 0.54 -0.81 0.00 0.00 175.30 175.70 3ffs s VAL 335 N -1.27 0.03 0.35 7.11 0.11 -1.26 -5.15 120.40 120.32 3ffs s VAL 335 Ca -0.03 -0.23 -0.28 0.00 -2.93 0.00 0.00 61.98 58.51 3ffs s VAL 335 Cb -0.10 -0.84 -0.11 0.00 -1.53 0.00 0.00 36.38 33.80 3ffs s VAL 335 CO 0.02 -0.13 1.43 -1.59 -3.33 0.00 0.00 175.10 171.51 3ffs s LYS 336 N -1.40 4.19 0.47 1.54 0.00 -1.26 -4.54 119.74 118.74 3ffs s LYS 336 Ca -0.11 2.45 -0.23 0.00 0.00 0.00 0.00 55.97 58.08 3ffs s LYS 336 Cb -0.02 -3.01 -0.07 0.00 0.00 0.00 0.00 37.83 34.73 3ffs s LYS 336 CO 0.06 -0.43 1.19 -0.47 0.00 0.00 0.00 175.35 175.70 3ffs s TYR 337 N -1.04 2.82 -0.00 1.78 5.04 -0.51 -4.30 117.35 121.13 3ffs s TYR 337 Ca 0.52 1.52 0.00 0.00 -2.44 0.00 0.00 57.07 56.67 3ffs s TYR 337 Cb -0.44 -3.43 -0.00 0.00 0.35 0.00 0.00 41.96 38.44 3ffs s TYR 337 CO 0.59 -1.64 0.01 1.63 -1.34 0.00 0.00 175.55 174.79 3ffs n LYS 338 N -0.52 3.74 0.00 4.97 5.02 0.27 -4.96 118.16 126.68 3ffs n LYS 338 Ca 0.07 -0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.36 3ffs n LYS 338 Cb 0.48 -0.74 0.00 0.00 -0.02 0.00 0.00 35.03 34.75 3ffs n LYS 338 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3ffs n GLY 339 N 1.69 -1.50 3.75 0.72 0.00 -1.26 -4.91 105.19 103.69 3ffs n GLY 339 Ca 0.00 -1.73 -0.38 0.00 0.00 0.00 0.00 46.02 43.91 3ffs n GLY 339 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3ffs s GLU 340 N 0.00 3.24 0.16 1.61 4.04 -1.26 -1.31 118.70 125.18 3ffs s GLU 340 Ca 0.00 2.07 0.20 0.00 0.04 0.00 0.00 54.97 57.28 3ffs s GLU 340 Cb 0.00 -2.24 -0.03 0.00 0.02 0.00 0.00 34.13 31.88 3ffs s GLU 340 CO 0.00 -1.06 1.00 0.00 -1.84 0.00 0.00 175.26 173.36 3ffs h MET 341 N 1.49 0.00 -0.96 -4.83 3.00 -1.95 -3.31 114.93 108.37 3ffs h MET 341 Ca -0.50 0.00 0.20 0.00 0.00 0.00 0.00 59.70 59.39 3ffs h MET 341 Cb 1.29 0.00 -0.08 0.00 0.00 0.00 0.00 31.60 32.80 3ffs h MET 341 CO 0.57 0.12 0.61 0.93 0.00 0.00 0.00 176.91 179.15 3ffs h GLU 342 N 0.00 0.56 -0.03 -0.10 5.08 -1.94 -2.00 114.58 116.14 3ffs h GLU 342 Ca -0.06 -0.03 -0.12 0.00 -1.00 0.00 0.00 59.36 58.15 3ffs h GLU 342 Cb 1.22 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 30.33 3ffs h GLU 342 CO 0.02 0.37 -0.53 0.78 -1.00 0.00 0.00 179.01 178.65 3ffs h GLY 343 N 0.58 0.09 2.00 -3.84 0.00 -1.98 0.25 103.07 100.17 3ffs h GLY 343 Ca 0.52 -0.10 -0.08 0.00 0.00 0.00 0.00 47.33 47.67 3ffs h GLY 343 CO -0.27 0.09 -0.40 -2.08 0.00 0.00 0.00 176.54 173.89 3ffs h VAL 344 N 0.07 0.98 0.07 4.60 2.07 -1.54 -3.08 116.25 119.42 3ffs h VAL 344 Ca -0.00 -1.54 -0.36 0.00 0.82 0.00 0.00 66.70 65.62 3ffs h VAL 344 Cb 0.96 1.91 -0.04 0.00 -1.52 0.00 0.00 31.29 32.61 3ffs h VAL 344 CO 0.07 0.39 -2.06 0.52 0.02 0.00 0.00 177.57 176.51 3ffs n VAL 345 N -3.62 1.67 -0.01 2.57 0.31 -0.97 -3.05 118.33 115.23 3ffs n VAL 345 Ca -0.01 -0.54 -0.11 0.00 -0.01 0.00 0.00 64.34 63.68 3ffs n VAL 345 Cb 0.50 -1.70 -0.05 0.00 -0.91 0.00 0.00 33.84 31.68 3ffs n VAL 345 CO 0.00 0.00 0.00 1.88 -1.32 0.00 0.00 176.83 177.39 3ffs h TYR 346 N -0.14 0.12 -0.64 3.52 0.99 -0.62 0.95 116.97 121.15 3ffs h TYR 346 Ca -0.47 0.00 0.07 0.00 2.00 0.00 0.00 58.73 60.33 3ffs h TYR 346 Cb 1.89 -0.04 -0.06 0.00 1.00 0.00 0.00 36.73 39.52 3ffs h TYR 346 CO 0.06 0.07 0.33 0.37 -0.00 0.00 0.00 178.16 178.99 3ffs h GLN 347 N 0.13 0.58 0.00 4.88 -0.00 -1.73 0.13 115.11 119.10 3ffs h GLN 347 Ca 0.05 -0.03 -0.06 0.00 -0.00 0.00 0.00 58.65 58.60 3ffs h GLN 347 Cb 0.00 -0.13 -0.01 0.00 0.00 0.00 0.00 27.48 27.34 3ffs h GLN 347 CO -0.03 0.38 -0.30 -0.07 0.00 0.00 0.00 178.83 178.81 3ffs h LEU 348 N 0.60 0.00 -0.12 -2.39 3.38 -1.34 -2.63 115.31 112.81 3ffs h LEU 348 Ca 0.30 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 58.17 3ffs h LEU 348 Cb 0.24 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.99 3ffs h LEU 348 CO -0.21 0.30 -0.29 0.58 0.09 0.00 0.00 178.44 178.91 3ffs h VAL 349 N 0.00 1.38 0.00 1.22 2.07 0.21 -3.18 116.25 117.95 3ffs h VAL 349 Ca -0.00 -1.58 -0.01 0.00 0.82 0.00 0.00 66.70 65.93 3ffs h VAL 349 Cb 0.64 2.09 -0.00 0.00 -1.52 0.00 0.00 31.29 32.50 3ffs h VAL 349 CO 0.04 0.47 -0.02 1.23 0.02 0.00 0.00 177.57 179.30 3ffs h GLY 350 N -0.01 0.00 1.30 2.17 0.00 -0.62 -2.08 103.07 103.83 3ffs h GLY 350 Ca -0.00 0.00 -0.28 0.00 0.00 0.00 0.00 47.33 47.05 3ffs h GLY 350 CO 0.06 0.00 -1.14 -1.33 0.00 0.00 0.00 176.54 174.13 3ffs h GLY 351 N 0.74 0.67 1.73 4.60 0.00 -1.47 -2.65 103.07 106.69 3ffs h GLY 351 Ca -0.00 -1.31 -0.14 0.00 0.00 0.00 0.00 47.33 45.89 3ffs h GLY 351 CO 0.00 1.15 -0.54 1.41 0.00 0.00 0.00 176.54 178.57 3ffs h LEU 352 N 0.30 0.32 0.13 3.11 3.38 -1.47 -1.04 115.31 120.04 3ffs h LEU 352 Ca -0.15 -0.17 0.02 0.00 0.09 0.00 0.00 57.88 57.67 3ffs h LEU 352 Cb 1.80 -0.09 -0.04 0.00 0.09 0.00 0.00 40.66 42.42 3ffs h LEU 352 CO 0.22 0.80 -0.37 0.03 0.09 0.00 0.00 178.44 179.21 3ffs h ARG 353 N 0.22 -0.58 -0.16 1.13 2.47 -1.42 -1.58 114.38 114.47 3ffs h ARG 353 Ca 0.00 0.04 -0.04 0.00 -1.26 0.00 0.00 59.98 58.72 3ffs h ARG 353 Cb 1.02 0.13 -0.00 0.00 -1.65 0.00 0.00 29.97 29.47 3ffs h ARG 353 CO 0.09 -0.39 -0.07 1.03 0.56 0.00 0.00 179.97 181.19 3ffs h SER 354 N -0.61 0.33 -0.36 7.04 0.87 -1.44 -1.38 113.55 118.00 3ffs h SER 354 Ca 0.02 -0.40 0.05 0.00 -1.23 0.00 0.00 61.79 60.23 3ffs h SER 354 Cb 0.63 -0.09 -0.05 0.00 -0.44 0.00 0.00 62.40 62.45 3ffs h SER 354 CO -0.21 0.66 0.08 0.00 -0.53 0.00 0.00 176.83 176.84 3ffs h MET 356 N 0.21 0.09 -0.52 0.00 2.07 -1.24 -1.69 114.93 113.85 3ffs h MET 356 Ca 0.17 -0.03 0.01 0.00 -2.07 0.00 0.00 59.70 57.78 3ffs h MET 356 Cb 0.19 -0.01 -0.03 0.00 -1.87 0.00 0.00 31.60 29.88 3ffs h MET 356 CO -0.22 0.41 0.33 0.78 1.07 0.00 0.00 176.91 179.28 3ffs h GLY 357 N 1.04 0.73 0.91 8.32 0.00 0.20 0.30 103.07 114.56 3ffs h GLY 357 Ca 0.01 -0.25 -0.09 0.00 0.00 0.00 0.00 47.33 46.99 3ffs h GLY 357 CO 0.05 0.24 -0.20 -0.97 0.00 0.00 0.00 176.54 175.65 3ffs h TYR 358 N 0.66 0.72 -0.24 5.60 -1.99 -0.96 -2.95 116.97 117.81 3ffs h TYR 358 Ca 0.20 -0.20 0.00 0.00 2.00 0.00 0.00 58.73 60.73 3ffs h TYR 358 Cb -0.04 -0.16 0.00 0.00 2.00 0.00 0.00 36.73 38.53 3ffs h TYR 358 CO -0.05 0.89 0.00 1.28 -0.00 0.00 0.00 178.16 180.28 3ffs n LEU 359 N -4.38 2.37 -3.64 3.88 4.32 -0.65 -2.21 117.00 116.70 3ffs n LEU 359 Ca -0.04 -1.20 -0.16 0.00 -0.02 0.00 0.00 56.01 54.59 3ffs n LEU 359 Cb 0.41 -0.44 0.01 0.00 -1.62 0.00 0.00 43.42 41.78 3ffs n LEU 359 CO 0.43 0.39 -0.08 0.61 -1.22 0.00 0.00 177.39 177.52 3ffs n GLY 360 N 0.49 -0.38 3.24 -0.72 0.00 0.98 -4.64 105.19 104.15 3ffs n GLY 360 Ca 0.10 0.16 -0.33 0.00 0.00 0.00 0.00 46.02 45.95 3ffs n GLY 360 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3ffs s SER 361 N -3.86 3.55 0.36 1.61 0.15 -0.79 -4.67 113.70 110.06 3ffs s SER 361 Ca 0.14 -0.51 0.10 0.00 0.70 0.00 0.00 55.95 56.39 3ffs s SER 361 Cb -0.08 -1.54 0.69 0.00 -1.71 0.00 0.00 66.02 63.38 3ffs s SER 361 CO 0.38 0.07 1.84 0.00 1.20 0.00 0.00 173.24 176.72 3ffs h ALA 362 N 7.41 1.38 -4.85 5.45 0.00 -1.92 -3.44 119.26 123.29 3ffs h ALA 362 Ca -0.34 -0.30 -0.52 0.00 0.00 0.00 0.00 54.91 53.75 3ffs h ALA 362 Cb 1.18 -0.07 -0.12 0.00 0.00 0.00 0.00 17.79 18.78 3ffs h ALA 362 CO 0.57 0.44 -0.44 -1.13 0.00 0.00 0.00 179.25 178.70 3ffs n SER 363 N -4.16 1.19 0.03 0.00 3.41 -1.26 -1.47 113.62 111.36 3ffs n SER 363 Ca -0.01 -3.04 -0.19 0.00 -0.26 0.00 0.00 58.87 55.36 3ffs n SER 363 Cb 0.37 0.98 -0.13 0.00 -0.26 0.00 0.00 64.21 65.17 3ffs n SER 363 CO 0.00 0.00 0.00 0.40 -0.16 0.00 0.00 175.04 175.28 3ffs h ILE 364 N 1.64 1.45 -0.08 -1.33 2.04 -1.83 -2.99 117.51 116.41 3ffs h ILE 364 Ca -0.30 -2.30 -0.07 0.00 1.00 0.00 0.00 64.86 63.18 3ffs h ILE 364 Cb 1.14 2.85 -0.01 0.00 -0.74 0.00 0.00 36.82 40.06 3ffs h ILE 364 CO 0.47 0.67 -0.29 -0.33 0.00 0.00 0.00 178.15 178.67 3ffs h GLU 365 N -0.17 0.14 0.14 2.37 4.39 -1.95 -2.46 114.58 117.05 3ffs h GLU 365 Ca -0.12 -0.05 0.02 0.00 0.34 0.00 0.00 59.36 59.56 3ffs h GLU 365 Cb 1.51 -0.01 -0.03 0.00 -0.10 0.00 0.00 28.75 30.12 3ffs h GLU 365 CO 0.15 0.42 -0.28 1.49 -1.16 0.00 0.00 179.01 179.62 3ffs h GLU 366 N 0.12 -0.49 -0.90 2.33 4.81 -1.97 -3.24 114.58 115.24 3ffs h GLU 366 Ca 0.02 0.03 0.07 0.00 -0.13 0.00 0.00 59.36 59.35 3ffs h GLU 366 Cb 0.58 0.11 -0.07 0.00 0.63 0.00 0.00 28.75 30.01 3ffs h GLU 366 CO 0.04 -0.33 0.57 1.25 -0.73 0.00 0.00 179.01 179.81 3ffs h LEU 367 N -0.51 0.89 0.00 1.64 5.85 -1.29 -1.70 115.31 120.18 3ffs h LEU 367 Ca 0.02 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.76 3ffs h LEU 367 Cb 0.53 -0.17 0.00 0.00 0.37 0.00 0.00 40.66 41.39 3ffs h LEU 367 CO -0.15 0.56 0.00 0.79 -0.34 0.00 0.00 178.44 179.30 3ffs n TRP 368 N -4.60 0.00 -0.05 1.25 7.02 -0.99 -1.94 117.44 118.13 3ffs n TRP 368 Ca 0.14 0.00 -0.05 0.00 -1.02 0.00 0.00 57.50 56.57 3ffs n TRP 368 Cb 0.20 0.00 -0.08 0.00 -2.42 0.00 0.00 31.31 29.01 3ffs n TRP 368 CO 0.00 0.00 0.00 0.36 -2.02 0.00 0.00 177.69 176.03 3ffs n LYS 369 N -0.89 2.26 -2.60 -0.99 -0.00 -0.65 -4.82 118.16 110.47 3ffs n LYS 369 Ca 0.08 -0.00 -0.26 0.00 -0.00 0.00 0.00 58.31 58.13 3ffs n LYS 369 Cb 0.04 -1.26 -0.01 0.00 -0.00 0.00 0.00 35.03 33.80 3ffs n LYS 369 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.40 177.76 3ffs n LYS 370 N -2.40 3.18 -4.01 -1.58 2.85 -0.82 -5.04 118.16 110.33 3ffs n LYS 370 Ca -0.17 -4.47 -0.31 0.00 -1.05 0.00 0.00 58.31 52.31 3ffs n LYS 370 Cb 0.82 -2.16 -0.15 0.00 -0.65 0.00 0.00 35.03 32.88 3ffs n LYS 370 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 177.40 176.23 3ffs s SER 371 N -3.48 4.13 -0.01 -5.58 0.01 -1.18 -4.95 113.70 102.64 3ffs s SER 371 Ca 0.47 -1.27 0.01 0.00 1.31 0.00 0.00 55.95 56.46 3ffs s SER 371 Cb 0.38 -1.38 -0.04 0.00 0.21 0.00 0.00 66.02 65.19 3ffs s SER 371 CO -0.16 -0.20 0.02 -0.44 0.41 0.00 0.00 173.24 172.87 3ffs s SER 372 N 1.24 5.29 0.06 2.44 0.01 -1.26 -5.02 113.70 116.46 3ffs s SER 372 Ca -0.07 0.05 0.01 0.00 1.31 0.00 0.00 55.95 57.25 3ffs s SER 372 Cb -0.19 -1.43 -0.03 0.00 0.21 0.00 0.00 66.02 64.57 3ffs s SER 372 CO -0.06 0.29 -0.06 -0.72 0.41 0.00 0.00 173.24 173.10 3ffs s TYR 373 N -1.10 0.66 0.17 2.43 1.13 -1.26 -0.73 117.35 118.64 3ffs s TYR 373 Ca 0.20 -0.77 0.10 0.00 -1.41 0.00 0.00 57.07 55.18 3ffs s TYR 373 Cb -0.12 -0.41 -0.04 0.00 -1.10 0.00 0.00 41.96 40.29 3ffs s TYR 373 CO 0.10 -0.19 -0.19 0.14 -2.51 0.00 0.00 175.55 172.91 3ffs s VAL 374 N -2.74 2.69 0.28 -3.49 -7.23 -0.58 -4.92 120.40 104.40 3ffs s VAL 374 Ca 0.01 -1.79 -0.18 0.00 -1.81 0.00 0.00 61.98 58.21 3ffs s VAL 374 Cb -0.01 -2.28 -0.09 0.00 0.56 0.00 0.00 36.38 34.56 3ffs s VAL 374 CO -0.04 -0.05 0.74 -1.61 -0.31 0.00 0.00 175.10 173.83 3ffs s GLU 375 N -2.55 4.14 0.11 4.82 2.02 -1.26 -1.28 118.70 124.70 3ffs s GLU 375 Ca 0.21 0.79 0.10 0.00 0.02 0.00 0.00 54.97 56.09 3ffs s GLU 375 Cb -0.09 -2.64 -0.04 0.00 0.10 0.00 0.00 34.13 31.46 3ffs s GLU 375 CO 0.11 0.27 -0.26 0.42 0.02 0.00 0.00 175.26 175.81 3ffs s ILE 376 N -1.77 2.27 0.21 -1.63 -1.09 0.85 -4.91 121.20 115.13 3ffs s ILE 376 Ca 0.49 -1.65 0.05 0.00 -2.23 0.00 0.00 60.65 57.31 3ffs s ILE 376 Cb -0.13 -1.98 -0.04 0.00 -1.58 0.00 0.00 42.46 38.74 3ffs s ILE 376 CO 0.19 0.16 0.23 0.42 -1.23 0.00 0.00 174.94 174.71 3ffs s THR 377 N -1.00 4.78 -1.65 2.92 -4.23 -1.26 -4.80 115.64 110.40 3ffs s THR 377 Ca 0.14 -1.11 0.00 0.00 -1.18 0.00 0.00 61.69 59.54 3ffs s THR 377 Cb -0.10 -3.53 0.00 0.00 1.34 0.00 0.00 72.50 70.21 3ffs s THR 377 CO 0.05 -0.24 0.24 1.07 -0.54 0.00 0.00 174.62 175.20 3ffs n THR 378 N -0.89 0.00 0.99 3.99 5.66 -1.26 -5.14 114.28 117.62 3ffs n THR 378 Ca -0.08 0.00 0.12 0.00 -3.05 0.00 0.00 64.05 61.04 3ffs n THR 378 Cb 0.56 -0.79 0.10 0.00 -1.55 0.00 0.00 70.33 68.66 3ffs n THR 378 CO 0.00 0.00 0.00 -0.24 -3.05 0.00 0.00 175.07 171.78